DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 11:08:58 UTC
Update Date	2025-03-24 21:03:06 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID01655473
Frequency	0.8
Structure
Chemical Formula	C₂₂H₃₃N₁₀O₂₁P₅
Molecular Mass	928.051
SMILES	CC1C(O)C(O)C(n2cnc3c(N)ncnc32)C1COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1O
InChI Key	DQXFXTJOYRTSEW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	nucleoside and nucleotide analogues
Subclass	cyclopentyl nucleosides
Direct Parent	cyclopentyl nucleosides
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	1,3-substituted cyclopentyl purine nucleosides azacyclic compounds cyclic alcohols and derivatives cyclopentanols 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 tetrahydrofurans
Substituents	pentose phosphate purine ribonucleoside monophosphate monosaccharide pentose-5-phosphate imidazopyrimidine pyrimidine saccharide organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound imidolactam organoheterocyclic compound azole n-substituted imidazole cyclopentyl nucleoside alcohol azacycle tetrahydrofuran purine nucleoside heteroaromatic compound cyclic alcohol cyclopentanol oxacycle 1,3-substituted cyclopentyl purine nucleoside 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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