DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 12:37:50 UTC
Update Date	2025-03-24 21:43:00 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID01867273
Frequency	0.7
Structure
Chemical Formula	C₂₀H₃₀N₁₁O₂₁P₅
Molecular Mass	915.0306
SMILES	Nc1ncnc2c1ncn2C1NC(COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(O)C2O)C(O)C1O
InChI Key	YATLRFHIGJLYGM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	nucleoside and nucleotide analogues
Subclass	nucleoside and nucleotide analogues
Direct Parent	nucleoside and nucleotide analogues
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	azacyclic compounds dialkylamines heteroaromatic compounds hydrocarbon derivatives imidazoles imidolactams monoalkyl phosphates monosaccharides n-substituted imidazoles organic oxides organopnictogen compounds oxacyclic compounds pentose phosphates primary amines purine nucleosides purine ribonucleoside monophosphates purines and purine derivatives pyrimidines and pyrimidine derivatives pyrrolidines secondary alcohols tetrahydrofurans
Substituents	pentose phosphate purine ribonucleoside monophosphate monosaccharide pentose-5-phosphate imidazopyrimidine pyrimidine saccharide organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound pyrrolidine imidolactam organoheterocyclic compound azole n-substituted imidazole alcohol secondary aliphatic amine azacycle tetrahydrofuran purine nucleoside heteroaromatic compound secondary amine oxacycle organic oxygen compound phosphoric acid ester monoalkyl phosphate secondary alcohol hydrocarbon derivative purine primary amine organic nitrogen compound organic phosphoric acid derivative amine alkyl phosphate organooxygen compound

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