DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:18:56 UTC
Update Date	2025-03-21 18:35:52 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00107733
Frequency	30.5
Structure
Chemical Formula	C₁₂H₁₄N₄O₇
Molecular Mass	326.0862
SMILES	Nc1nc2c(c(C(=O)O)cn2C2OC(CO)C(O)C2O)c(=O)[nH]1
InChI Key	LVTNUSALLLYISD-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	1-carboxy-2-haloaromatic compounds amino acids azacyclic compounds heteroaromatic compounds hydrocarbon derivatives lactams monocarboxylic acids and derivatives monosaccharides organic oxides organopnictogen compounds oxacyclic compounds primary alcohols primary amines pyrimidinecarboxylic acids pyrimidones pyrrole carboxylic acids pyrrolo[2,3-d]pyrimidines secondary alcohols substituted pyrroles tetrahydrofurans vinylogous amides
Substituents	lactam carboxylic acid pyrrole-3-carboxylic acid or derivatives amino acid or derivatives amino acid monosaccharide pyrimidone substituted pyrrole carboxylic acid derivative pyrimidine pyrrolopyrimidine saccharide organic oxide pyrrolo[2,3-d]pyrimidine aromatic heteropolycyclic compound organonitrogen compound organopnictogen compound 1-carboxy-2-haloaromatic compound primary alcohol organoheterocyclic compound alcohol vinylogous amide azacycle tetrahydrofuran heteroaromatic compound pyrimidine-5-carboxylic acid pyrrolopyrimidine ribonucleoside oxacycle monocarboxylic acid or derivatives organic oxygen compound pyrrole secondary alcohol hydrocarbon derivative primary amine organic nitrogen compound pyrrole-3-carboxylic acid amine organooxygen compound

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