DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 17:25:49 UTC
Update Date	2025-03-25 01:51:06 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02538938
Frequency	0.5
Structure
Chemical Formula	C₂₀H₃₀N₇O₂₃P₅
Molecular Mass	891.0081
SMILES	Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3OP(=O)(O)O)O2)c(=O)[nH]c1=O
InChI Key	FEIJYYSPAWHJGK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	ribonucleoside 3'-phosphates
Subclass	ribonucleoside 3'-phosphates
Direct Parent	ribonucleoside 3'-phosphates
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	azacyclic compounds heteroaromatic compounds hydrocarbon derivatives imidazoles imidolactams lactams monoalkyl phosphates monosaccharides n-substituted imidazoles organic carbonic acids and derivatives organic oxides organopnictogen compounds oxacyclic compounds pentose phosphates primary amines purine ribonucleoside 3',5'-bisphosphates purines and purine derivatives pyrimidine 2'-deoxyribonucleoside polyphosphates pyrimidones secondary alcohols tetrahydrofurans vinylogous amides
Substituents	lactam pentose phosphate monosaccharide pentose-5-phosphate pyrimidone imidazopyrimidine pyrimidine saccharide organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound imidolactam organoheterocyclic compound azole n-substituted imidazole purine ribonucleoside 3',5'-bisphosphate ribonucleoside 3'-phosphate alcohol vinylogous amide carbonic acid derivative azacycle tetrahydrofuran heteroaromatic compound oxacycle organic oxygen compound phosphoric acid ester monoalkyl phosphate secondary alcohol hydrocarbon derivative purine pyrimidine 2'-deoxyribonucleoside polyphosphate primary amine organic nitrogen compound organic phosphoric acid derivative amine alkyl phosphate organooxygen compound

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