DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:12:31 UTC
Update Date	2025-03-21 18:32:40 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00092029
Frequency	30.4
Structure
Chemical Formula	C₁₂H₁₄N₄O₇
Molecular Mass	326.0862
SMILES	Nc1nc2c(cc(C(=O)O)n2C2OC(CO)C(O)C2O)c(=O)[nH]1
InChI Key	VOUOUTUGSHTECZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	pyrrolopyrimidine nucleosides and nucleotides
Subclass	pyrrolopyrimidine nucleosides and nucleotides
Direct Parent	pyrrolopyrimidine nucleosides and nucleotides
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	amino acids azacyclic compounds carboxylic acids heteroaromatic compounds hydrocarbon derivatives lactams monocarboxylic acids and derivatives monosaccharides organic oxides organopnictogen compounds oxacyclic compounds primary alcohols primary amines pyrimidinecarboxylic acids pyrimidones pyrrole 2-carboxylic acids pyrrole carboxylic acids and derivatives pyrrolo[2,3-d]pyrimidines secondary alcohols substituted pyrroles tetrahydrofurans vinylogous amides
Substituents	lactam carboxylic acid amino acid or derivatives amino acid monosaccharide pyrimidone substituted pyrrole carboxylic acid derivative pyrimidine pyrrolopyrimidine saccharide organic oxide pyrrolo[2,3-d]pyrimidine pyrrole-2-carboxylic acid pyrrole-2-carboxylic acid or derivatives aromatic heteropolycyclic compound organonitrogen compound organopnictogen compound primary alcohol pyrimidine-6-carboxylic acid organoheterocyclic compound alcohol vinylogous amide azacycle tetrahydrofuran heteroaromatic compound pyrrolopyrimidine ribonucleoside oxacycle monocarboxylic acid or derivatives organic oxygen compound pyrrole secondary alcohol hydrocarbon derivative primary amine organic nitrogen compound amine organooxygen compound

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