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Superclasses:
acetylides
alkaloids and derivatives
allenes
benzenoids
hydrocarbon derivatives
hydrocarbons
lignans, neolignans and related compounds
lipids and lipid-like molecules
nucleosides, nucleotides, and analogues
organic 1,3-dipolar compounds
organic acids and derivatives
organic nitrogen compounds
organic oxygen compounds
organic polymers
organic salts
organohalogen compounds
organoheterocyclic compounds
organophosphorus compounds
organosulfur compounds
phenylpropanoids and polyketides
Classes:
1,2-diaryl-2-propen-1-ols
1,3-thiazolo[5,4-d]pyrimidines
1-azafluoranthenes
1-hydroxylamino, 2-unsubstituted benzenoids
1-hydroxylamino, 4-unsubstituted benzenoids
2',3'-dideoxy-3'-thionucleoside monophosphates
2',5'-dideoxyribonucleosides
2-arylbenzofuran flavonoids
3,4-dihydrocoumarins
5'-deoxyribonucleosides
6,6a-secoaporphines
6,7-benzomorphans
acenaphthylenes
acyclic allenes
acyl halides
alkyl halides
allyl sulfur compounds
allyl-type 1,3-dipolar organic compounds
alpha-methyldeoxybenzoin flavonoids
amaryllidaceae alkaloids
aminosulfonodithioyl compounds
angucyclines
anthracenes
aporphines
aryl halides
arylnaphthalene lignans
aryltetralin lignans
aurone flavonoids
azacyclic compounds
azaspirodecane derivatives
azepanes
azepines
azetidines
aziridines
azobenzenes
azoles
azolidines
azolines
benzazepines
benzene and substituted derivatives
benzimidazole ribonucleosides and ribonucleotides
benzimidazoles
benzisoxazoles
benzo-1,2,3-triazines
benzocycloheptapyridines
benzodiazepines
benzodioxanes
benzodioxins
benzodioxoles
benzodithiins
benzofurans
benzopyrans
benzopyrazoles
benzothiadiazoles
benzothiazepines
benzothiazines
benzothiazoles
benzothiepins
benzothiophenes
benzothiopyrans
benzotriazole ribonucleosides and ribonucleotides
benzotriazoles
benzoxadiazoles
benzoxathiins
benzoxathioles
benzoxazepines
benzoxazines
benzoxazoles
benzoxazolines
benzoxepines
biotin and derivatives
carbodithioic acid esters
carbodithioic acids
carbodithiolactones
carbothioic o-acids
carbothioic s-lactones
carboximidic acids and derivatives
carboxylic acids and derivatives
cinchona alkaloids
cinnamaldehydes
cinnamic acids and derivatives
cinnamyl alcohols
coumarans
coumarinolignans
coumarins and derivatives
cularin alkaloids and derivatives
cyanide salts
cyclic allenes
cyclobutane lignans
cycloheptafurans
cycloheptapyrans
cycloheptathiophenes
depsides and depsidones
diarylheptanoids
diazanaphthalenes
diazaspirononane derivatives
diazepanes
diazepines
diazinanes
diazines
dibenzazecins
dibenzocycloheptenes
dibenzylbutane lignans
dihydrofurans
dihydroisoquinolines
dihydrothiophenes
dihydroxyphosphanes
dioxanes
dioxaphospholanes
dioxathiolanes
dioxepanes
dioxepines
dioxetanes
dioxins
dioxolanes
dioxoles
dioxolopyrans
dithianes
dithietanes
dithiins
dithiocarbamic acids and derivatives
dithiolanes
dithioles
dithiosulfonic o-acids
endocannabinoids
epoxides
epoxypiperidines
erythrina alkaloids
fatty acyls
flavin nucleotides
flavonoids
flavonolignans
fluorenes
furanoid lignans
furans
furo[2,3-d]pyrimidines
furo[3,2-d]pyrimidine glycosides
furofurans
furopyrans
furopyridines
furopyrroles
glycero-3-thiophosphocholines
glycerolipids
glycerophospholipids
glycerophosphonolipids
glycinamide ribonucleotides
haloacetylenes and derivatives
halohydrins
harmala alkaloids
hasubanan alkaloids
heteroaromatic compounds
homoaporphines
homoisoflavonoids
hydrobromides
hydrochlorides
hydroxy acids and derivatives
imidazo[1,2-a][1,2,4]triazines
imidazo[1,2-a]pyrazin-8-ones
imidazo[1,2-a]pyridines
imidazo[1,2-a]pyrimidines
imidazo[1,2-d][1,2,4]triazines
imidazo[1,5-a]pyrazines
imidazodiazepines
imidazole ribonucleosides and ribonucleotides
imidazole[4,5-c]pyridine ribonucleosides and ribonucleotides
imidazopiperidines
imidazopyrazines
imidazopyridines
imidazopyrimidines
imidazothiazoles
imidolactams
imidothioesters
imidothioic acids and derivatives
imidoyl halides
indanes
indazole ribonucleosides and ribonucleotides
indenes and isoindenes
indeno[1,2-c]pyrazoles
indole ribonucleosides and ribonucleotides
indoles and derivatives
indolizidines
isoaporphines
isobenzofurans
isochromanequinones
isocoumarans
isocoumarins and derivatives
isoflavonoids
isoindoles and derivatives
isopavine alkaloids
isoquinolines and derivatives
isothiochromanes
isothiochromenes
isothiocyanates
isothioureas
isoxazolopyridines
keto acids and derivatives
lactams
lactones
lignan glycosides
lignan lactones
linear 1,3-diarylpropanoids
lupin alkaloids
macrolactams
macrolide lactams
metalloheterocyclic compounds
morphinans
n-phenylhydroxylamines
naphthacenes
naphthalenes
naphthofurans
naphthopyrans
neoflavonoids
nitronic acids
nucleoside and nucleotide analogues
o-phenylhydroxylamines
organic carbonic acids and derivatives
organic disulfides
organic dithiophosphoric acids and derivatives
organic hydroperoxides
organic nitric acids and derivatives
organic oxides
organic oxoanionic compounds
organic oxoazanium compounds
organic phosphines and derivatives
organic phosphonic acids and derivatives
organic phosphoric acids and derivatives
organic sulfonic acids and derivatives
organic sulfuric acids and derivatives
organic thioperoxides
organic thiophosphoric acids and derivatives
organic thiosulfinic acids
organic thiosulfuric acids and derivatives
organic trisulfides
organobromides
organochlorides
organonitrogen compounds
organooxygen compounds
organophosphinic acids and derivatives
organosulfenic acids and derivatives
organothiophosphorus compounds
orthocarboxylic acid derivatives
oxacyclic compounds
oxamorphinans
oxanes
oxaphospholanes
oxathianes
oxathietanes
oxathiins
oxathiolanes
oxathioles
oxazaphosphinanes
oxazepines
oxazinanes
oxazines
oxazolopyrazines
oxazolopyridines
oxepanes
oxetanes
oxetenes
oxirenes
oxocins
pavine alkaloids
peptidomimetics
phenalanes
phenalenes
phenanthrenes and derivatives
phenanthrolines
phenethylisoquinoline alkaloids
phenol esters
phenol ethers
phenols
phenylpropanoic acids
phosphacyclic compounds
piperazinoazepines
piperazinopiperidines
piperidines
polycyclic hydrocarbons
polypeptides
prenol lipids
propargyl-type 1,3-dipolar organic compounds
protoberberine alkaloids and derivatives
pteridines and derivatives
purine nucleosides
purine nucleotides
pyranodioxins
pyranopyridines
pyranopyrimidines
pyrans
pyrazole ribonucleosides and ribonucleotides
pyrazolo[1,5-a][1,3,5]triazines
pyrazolo[3,4-b]pyrazines
pyrazolo[3,4-d]pyrimidine glycosides
pyrazolopyrazoles
pyrazolopyridines
pyrazolopyrimidines
pyrenes
pyridine nucleotides
pyridines and derivatives
pyridodiazepines
pyridopyrazines
pyridopyrimidines
pyrimidine nucleosides
pyrimidine nucleotides
pyrimidodiazepines
pyrroles
pyrrolidines
pyrrolines
pyrrolizidines
pyrrolizines
pyrrolo[3,4-d]pyridazines
pyrroloazepines
pyrrolopyrazines
pyrrolopyrazoles
pyrrolopyridines
pyrrolopyrimidine nucleosides and nucleotides
pyrrolopyrimidines
pyrrolothiazoles
pyrrolotriazines
quinodimethanes
quinolidines
quinolines and derivatives
quinolizidines
quinolizines
quinuclidines
ribonucleoside 3'-phosphates
saccharolipids
saturated hydrocarbons
sphingolipids
sterigmatocystins
steroids and steroid derivatives
stilbenes
stilbenolignans
sulfamic acid derivatives
sulfenyl compounds
sulfimides
sulfines
sulfinic acids and derivatives
sulfinyl compounds
sulfonimidic acids
sulfonyl halides
sulfonyls
sulfoxides
sultams
sultims
tannins
tetrahydrofurans
tetrahydroisoquinolines
tetralins
tetrapyrroles and derivatives
tetrathianes
tetrazines
thiadiazinanes
thiadiazines
thianes
thiazepines
thiazetidines
thiazinanes
thiazines
thiaziridines
thieno[2,3-d]pyrimidine glycosides
thienodiazepines
thienoimidazoles
thienoimidazolidines
thienopyrans
thienopyridines
thienopyrimidines
thienopyrroles
thienothiazines
thienothiazoles
thiepanes
thietanes
thietes
thiiranes
thioacetals
thioamides
thiocarbamic acids
thiocarbonyl compounds
thiocarboxylic acids and derivatives
thiochromanes
thiochromenes
thiocyanates
thioethers
thiohemiaminal derivatives
thiolactams
thiolactones
thiolanes
thiols
thiophenes
thiophenol esters
thiophenols
thiopyrans
thiosulfinic acid esters
thioureas
trialkylphosphites
triazinanes
triazines
triazole ribonucleosides and ribonucleotides
triazolopyrazines
triazolopyridazines
triazolopyridines
triazolopyrimidines
trioxanes
trioxolanes
triphenyl compounds
trithianes
trithiolanes
trithiosulfonic acids
tropane alkaloids
tropones
unsaturated hydrocarbons
vinyl halides
vinylogous acids
vinylogous amides
vinylogous esters
vinylogous thioesters
Subclasses:
1,2,3-triazinanes
1,2,3-triazines
1,2,4-triazines
1,2-diaryl-2-propen-1-ols
1,2-diazepanes
1,2-dioxanes
1,2-dioxepanes
1,2-dioxolanes
1,2-dioxoles
1,2-dithiolanes
1,2-dithioles
1,2-oxazepines
1,2-oxazinanes
1,2-oxazines
1,2-thiazines
1,3,5-triazinanes
1,3,5-triazines
1,3-diazepanes
1,3-diazepines
1,3-dioxanes
1,3-dioxepanes
1,3-dioxepines
1,3-dioxolanes
1,3-dioxoles
1,3-dithiolanes
1,3-isoquinolinediones
1,3-oxazepines
1,3-oxazinanes
1,3-oxazines
1,3-thiazines
1,3-thiazolo[5,4-d]pyrimidines
1,4-benzodiazepines
1,4-benzodithiins
1,4-diazepanes
1,4-diazepines
1,4-dihydroxy-2-halobenzenoids
1,4-dioxanes
1,4-dioxepanes
1,4-dioxepines
1,4-isoquinolinediones
1,4-oxazepines
1,4-oxazines
1,4-thiazines
1-azafluoranthenes
1-benzopyrans
1-benzothiophenes
1-benzothiopyrans
1-benzylquinolines
1-hydroxy-2-unsubstituted benzenoids
1-hydroxy-4-unsubstituted benzenoids
1-hydroxylamino, 2-unsubstituted benzenoids
1-hydroxylamino, 4-unsubstituted benzenoids
1-phenethyltetrahydroisoquinolines
1-phenylcoumarans
1-phenyltetrahydroisoquinolines
1-phosphoribosyl-imidazoles
1-pyranosylbenzimidazoles
1-pyranosylindoles
1-ribosyl-imidazolecarboxamides
2',3'-cyclic purine nucleoside phosphorothioates
2',3'-dideoxy-3'-thionucleoside monophosphates
2',5'-dideoxyribonucleosides
2,3,5-trisubstituted thiophenes
2,5-disubstituted thiophenes
2,6-dimethyl-3-benzazocines
2-arylbenzofuran flavonoids
2-benzopyrans
2-benzothiophenes
2-benzothiopyrans
2-phenoxypropionic acid esters
2-phenoxypropionic acids
2-pyranosylbenzoxazoles
2-pyranosylindazoles
2-pyridylmethylamines
2-ribofuranosylbenzotriazoles
2-ribofuranosylindazoles
3',5'-cyclic purine nucleoside phosphorothioates
3',5'-cyclic pyrimidine nucleoside phosphorothioates
3'-thia pyrimidine nucleosides
3,4-dihydrocoumarins
3-arylcoumarin flavonoids
3-phenoxypropionic acids
3-pyridinecarbonitriles
3-ribofuranosylpyrazoles
4-alkoxyphenols
4-aroylquinolines
4-hydroxy-2-alkylquinolines
4-hydroxy-6,7-benzomorphans
4-phenyltetrahydroisoquinolines
4-quinolinemethanols
5'-deoxy-5'-thionucleosides
5'-deoxyribonucleosides
6,6a-secoaporphines
6,7-benzomorphans
7-oxo-1,3-thiazolo[5,4-d]pyrimidines
8-hydroxyquinolines
acenaphthylenes
acetophenones
acetylenes
acetylides
acryloyl compounds
acyclic allenes
acyl bromides
acyl chlorides
acyl fluorides
acyl iodides
acyltrehaloses
alcohols and polyols
alkaloids and derivatives
alkanes
alkanesulfinic acids and derivatives
alkoxides
alkyl bromides
alkyl chlorides
alkyl fluorides
alkyl iodides
alkyl sulfates
alkyldiazohydroxides
alkylthiols
alloxazines and isoalloxazines
allyl sulfur compounds
allyl-type 1,3-dipolar organic compounds
allylic hydroperoxides
alpha hydroxy acids and derivatives
alpha-halocarboxylic acids and derivatives
alpha-imino acid and derivatives
alpha-keto acids and derivatives
alpha-methyldeoxybenzoin flavonoids
amidines
aminals
amines
amino acids, peptides, and analogues
aminophenyl ethers
aminopiperidines
aminopyridines and derivatives
aminoquinolines and derivatives
aminosulfonodithioyl compounds
aminotriazines
aminoxides
androstane steroids
angucyclines
anilides
aniline and substituted anilines
anisoles
anthocyanidins
anthracenecarboxylic acids and derivatives
anthracenes
anthraquinones
aporphines
aryl bromides
aryl chlorides
aryl fluorides
aryl iodides
aryl thioethers
arylnaphthalene lignans
arylsulfates
aryltetralin lignans
aurone flavonoids
auronols
azacyclic compounds
azaspirodecane derivatives
azasteroids and derivatives
azepanes
azepines
azetidinecarboxylic acids or derivatives
azetidines
aziridines
azo compounds
azobenzenes
azoles
azonic acids and derivatives
azoxy compounds
benzazepines
benzazocines
benzene and substituted derivatives
benzenediols
benzenesulfonamides
benzenesulfonic acids and derivatives
benzenesulfonyl compounds
benzenetriols and derivatives
benzenoids
benzimidazole ribonucleosides and ribonucleotides
benzimidazoles
benzisoxazoles
benzisoxazolones
benzo-1,2,3-triazines
benzo-1,2-dioxanes
benzo-1,3-dioxanes
benzo-1,4-dioxanes
benzo-p-dioxins
benzocycloheptapyridines
benzodiazepines
benzodiazines
benzodifurans
benzodioxoles
benzofuranones
benzofurans
benzoic acids and derivatives
benzoins
benzonitriles
benzophenones
benzopyrenes
benzoquinolines
benzothiadiazines
benzothiadiazoles
benzothiazepines
benzothiazines
benzothiazoles
benzothiepins
benzotriazole ribonucleosides and ribonucleotides
benzotriazoles
benzoxadiazoles
benzoxathiins
benzoxathioles
benzoxazepines
benzoxazines
benzoxazinones
benzoxazoles
benzoxazolines
benzoxazolones
benzoxepines
benzoyl derivatives
benzoylindoles
benzyl alcohols
benzyl cyanides
benzyl halides
benzyl isothiocyanates
benzyl sulfoxides
benzylamines
benzylethers
benzylisoquinolines
benzyloxycarbonyls
benzylpiperidines
beta hydroxy acids and derivatives
beta lactams
beta propiolactones
beta sultams
beta sultims
beta sultones
beta-keto acids and derivatives
beta-sulfonopeptides
bile acids, alcohols and derivatives
bilirubins
biotin and derivatives
biphenyls and derivatives
bipyridines and oligopyridines
bisphosphonates
branched unsaturated hydrocarbons
bromohydrins
butyrophenones
caprolactams
carbazoles
carbo-azosulfones
carbodiimides
carbodithioic acid esters
carbodithioic acids
carbodithiolactones
carbohydrates and carbohydrate conjugates
carbonic acid diesters
carbonic acid monoesters
carbonyl compounds
carbothioic o-acids
carbothioic s-lactones
carboximidamides
carboximidic acids
carboxylic acid amide acetals
carboxylic acid derivatives
carboxylic acid orthoesters
carboxylic acids
carboxylic acids and derivatives
cdp-glycerols
ceramides
chalcones and dihydrochalcones
chlorohydrins
chloronaphthalenes
cholestane steroids
chrysenes
cinchona alkaloids
cinnamaldehydes
cinnamic acids and derivatives
cinnamyl alcohols
cinnamylphenols
complex tannins
coumarans
coumarin glycosides
coumarino-alpha-pyrones
coumarino-gamma-pyrones
coumarinolignans
coumarins and derivatives
coumaronochromenes
coumaronochromones
coumestans
cresols
cularin alkaloids and derivatives
cumenes
cyanates
cyanide salts
cyclamates
cyclic allenes
cyclic imidoyl halides
cyclic purine nucleotides
cyclic pyrimidine nucleotides
cycloalkanes
cyclobutane lignans
cyclobutyl nucleosides
cycloheptafurans
cycloheptapyrans
cycloheptathiophenes
cyclohexyl halides
cyclohexylamines
cyclohexylphenols
cyclopentyl nucleosides
cyclopropanecarboxylic acids and derivatives
dalbergiones
delta sultams
delta sultones
delta valerolactones
delta-4-steroids
delta-5-steroids
delta-7-steroids
depsides and depsidones
depsipeptides
dialkyldisulfides
dialkylthioethers
diazaspirononane derivatives
diazinanes
diazoethers
dibenzazecins
dibenzazepines
dibenzocycloheptenes
dibenzodiazepines
dibenzofurans
dibenzothiazepines
dibenzothiepins
dibenzothiophenes
dibenzoxazepines
dibenzoxepines
dibenzylbutane lignans
dicarboxylic acids and derivatives
difurocoumarins
dihydrofurans
dihydroisoquinolines
dihydrothiophenes
dihydroxyphosphanes
dinaphthofurans
dioxaphospholanes
dioxathiolanes
dioxetanes
dioxolopyrans
diphenylacetonitriles
diphenylethers
diphenylmethanes
diradylglycerols
diterpenoids
dithianes
dithiazinanes
dithiazoles
dithietanes
dithiins
dithioacetals
dithiocarbamic acid esters
dithiohemiacetals
dithiophosphate o-esters
dithiophosphate s-esters
dithiosulfonic o-acids
eicosanoids
endocannabinoids
enol ester epoxides
enynes
epoxides
epoxypiperidines
ergostane steroids
erythrinanes
estrane steroids
ethers
fatty acid esters
fatty acids and conjugates
fatty acyl glycosides
fatty acyl thioesters
fatty alcohol esters
fatty alcohols
fatty aldehydes
fatty amides
flav-3-enes
flavans
flavin nucleotides
flavones
flavonoid 3-phosphates
flavonoid glycosides
flavonoids
flavonolignans
fluorenes
fluorohydrins
furan lignans
furanocoumarins
furanoisoflavonoids
furanonaphthodioxoles
furanones
furanoquinolines
furans
furo[2,3-c]pyridines
furo[2,3-d]pyrimidines
furo[3,2-c]pyridines
furo[3,2-d]pyrimidine glycosides
furofurans
furoic acid and derivatives
furopyrans
furopyridines
furopyrroles
furostanes and derivatives
gamma butyrolactones
gamma sultims
gamma sultones
gamma-keto acids and derivatives
glycero-3-pyrophosphates
glycero-3-thiophosphocholines
glycerol ethers
glycerol vinyl ethers
glycerolipids
glycerophosphates
glycerophosphocholines
glycerophosphoethanolamines
glycerophosphoglycerols
glycerophosphoinositols
glycerophospholipids
glycerophosphonolipids
glycerophosphoserines
glycinamide ribonucleotides
glycopeptidomimetics
glycosphingolipids
glycosylglycerols
glycosylglycerophospholipids
gorgostanes and derivatives
guanidines
haloacetylenes and derivatives
halobenzenes
halogenated steroids
halomethanes
halophenols
halopyridines
haloquinolines
harmala alkaloids
hasubanan alkaloids
heteroaromatic compounds
hexacarboxylic acids and derivatives
homoaporphines
homoisoflavans
homoisoflavones
homoisoflavonoids
hopanoids
hybrid peptides
hydrazinecarboxylic acids and derivatives
hydrazines and derivatives
hydrobromides
hydrocarbon derivatives
hydrochlorides
hydrolyzable tannins
hydropyridines
hydroquinolines
hydroxycinnamic acids and derivatives
hydroxycoumarins
hydroxyflavonoids
hydroxypyridines
hydroxyquinolines
hydroxysteroids
imidazo[1,2-a][1,2,4]triazines
imidazo[1,2-a]pyrazin-8-ones
imidazo[1,2-a]pyridines
imidazo[1,2-a]pyrimidines
imidazo[1,2-d][1,2,4]triazines
imidazo[1,5-a]pyrazines
imidazodiazepines
imidazole ribonucleosides and ribonucleotides
imidazole[4,5-c]pyridine ribonucleosides and ribonucleotides
imidazoles
imidazolidines
imidazolines
imidazopiperidines
imidazopyrazines
imidazopyridines
imidazopyridinones
imidazopyrimidines
imidazoquinolines
imidazothiazoles
imidoesters
imidolactams
imidothioesters
imidothioic acids and derivatives
imidothiolactones
imidoyl chlorides
imidoyl fluorides
imines
indan-1-spirocyclohexanes
indanes
indanones
indazole ribonucleosides and ribonucleotides
indazoles
indenes and isoindenes
indeno[1,2-c]pyrazoles
indenoazepines
indole ribonucleosides and ribonucleotides
indolecarboxylic acids and derivatives
indolequinones
indoles
indolines
indolizidines
indolizines
iodohydrins
isoaporphines
isobenzofuranones
isobenzofurans
isochromanequinones
isocoumarans
isocoumarins and derivatives
isocyanates
isoflav-2-enes
isoflav-3-enes
isoflavans
isoflavonoid c-glycosides
isoflavonoid o-glycosides
isoflavonoids
isoindoles
isoindolines
isopavine alkaloids
isoprenoid phosphates
isoquinoline quinones
isoquinolines and derivatives
isoquinolones and derivatives
isosorbides
isothiochromanes
isothiochromenes
isothiocyanate acids
isothiocyanates
isothioureas
isoxazoles
isoxazolidines
isoxazolines
isoxazolopyridines
ketenes
lactams
lactones
lignan glycosides
lignan lactones
lignans, neolignans and related compounds
linear 1,3-diarylpropanoids
linear diarylheptanoids
lineolic acids and derivatives
lipoamides
lipoic acids and derivatives
lupinine-type alkaloids
m-quinodimethanes
macrolactams
macrolide lactams
medium-chain hydroxy acids and derivatives
medium-chain keto acids and derivatives
meta thiazepines
metallotetrapyrroles
methoxybenzenes
methoxyphenols
methylpyridines
monocarboxylic acids and derivatives
monoradylglycerols
monoterpenoids
monothioacetals
morphinans
morpholines
n,s-acetals
n-acylpiperidines
n-acylpyrrolidines
n-alkylindoles
n-alkylpyrrolidines
n-arylamides
n-organohydroxylamines
n-phenylhydroxylamines
n-phenylthioureas
n-phenylureas
naphthacenes
naphthalene sulfonic acids and derivatives
naphthalenecarboxylic acids and derivatives
naphthalenes
naphthofurans
naphthols and derivatives
naphthopyranones
naphthopyrans
naphthoquinones
naphthothiophenes
naphthylisoquinolines
naphthyridines
neoflavans
neoflavenes
neoflavones
neoflavonoid 7-o-glycosides
neoflavonoids
nicotinamide nucleotides
nicotinic acid nucleotides
nitrate esters
nitrobenzenes
nitrofurans
nitrogen mustard compounds
nitronaphthalenes
nitrones
nitronic acids
nitrophenols
nitroquinolines and derivatives
nitrosopiperidines
nitrothiophenes
norbelladine-type amaryllidaceae alkaloids
nucleoside and nucleotide analogues
o-methylated flavonoids
o-methylated isoflavonoids
o-phenylhydroxylamines
o-quinodimethanes
olefins
organic carbonic acids
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ID
Structure
Exact Mass
Formula
Frequency
HMDB ID and Name
Status
DMID00002903
152.0473
C8H8O3
2041.8
Not Available
Not Available
DMID00003510
179.0807
C7H9N5O
2041.5
Not Available
Not Available
DMID00002904
117.0426
C4H7NO3
2041.4
Not Available
Not Available
DMID00002906
169.0739
C8H11NO3
2041.0
HMDB0004817
5-Hydroxydopamine
quantified
DMID00002929
229.1314
C11H19NO4
2040.9
Not Available
Not Available
DMID00002907
344.0743
C14H16O10
2040.0
HMDB0060024
Vanillic acid 4-O-glucuronide
detected
DMID00002908
205.0375
C10H7NO4
2039.2
HMDB0000881
Xanthurenic acid
quantified
DMID00002921
243.1583
C11H21N3O3
2036.1
HMDB0029022
Prolyl-Lysine
expected
DMID00002910
136.0524
C8H8O2
2035.5
HMDB0124942
4-ethenylbenzene-1,2-diol
predicted
DMID00002911
160.0524
C10H8O2
2035.1
Not Available
Not Available
DMID00002912
418.368
C27H48NO2+
2034.7
Not Available
Not Available
DMID00002914
412.4149
C26H54NO2+
2033.5
Not Available
Not Available
DMID00002915
158.0943
C8H14O3
2032.1
Not Available
Not Available
DMID00002916
172.1463
C10H20O2
2032.0
HMDB0038602
Octyl acetate
quantified
DMID00003824
445.171
C19H23N7O6
2030.2
HMDB0001846
Tetrahydrofolic acid
quantified
DMID00002917
144.115
C8H16O2
2030.2
HMDB0000482
Caprylic acid
quantified
DMID00002918
160.1099
C8H16O3
2029.9
HMDB0000711
Hydroxyoctanoic acid
detected
DMID00002919
110.0038
C2H6O3S
2029.8
Not Available
Not Available
DMID00002920
172.0524
C11H8O2
2028.7
HMDB0245249
2-Naphthoic acid
detected
DMID00002922
853.3063
C32H55NO25
2028.6
Not Available
Not Available
DMID00002923
151.0997
C9H13NO
2028.4
Not Available
Not Available
DMID00002925
182.0579
C9H10O4
2026.0
HMDB0126386
3-(2,4-Dihydroxyphenyl)propanoic acid
detected
DMID00003197
211.0705
C7H9N5O3
2025.8
HMDB0060410
6-Carboxy-5,6,7,8-tetrahydropterin
expected
DMID00004862
253.0811
C9H11N5O4
2025.6
HMDB0000845
Neopterin
quantified
DMID00002926
170.0215
C7H6O5
2025.6
Not Available
Not Available
Displaying metabolites
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