DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:22:18 UTC
Update Date	2025-03-25 01:01:54 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02252365
Frequency	0.5
Structure
Chemical Formula	C₁₀H₁₅N₃O₁₃P₂
Molecular Mass	447.008
SMILES	Nc1cc(C(=O)O)n(C2OC(COP(=O)(O)O)C(OP(=O)(O)O)C2O)c(=O)n1
InChI Key	CWOMDPAQKLKLQI-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 heteromonocyclic compounds
Alternative Parents	amino acids azacyclic compounds carboxylic acids heteroaromatic compounds hydrocarbon derivatives imidolactams monoalkyl phosphates monocarboxylic acids and derivatives monosaccharides organic carbonic acids and derivatives organic oxides organopnictogen compounds oxacyclic compounds pentose phosphates primary amines pyrimidinecarboxylic acids pyrimidones secondary alcohols tetrahydrofurans
Substituents	carboxylic acid aromatic heteromonocyclic compound pentose phosphate amino acid or derivatives amino acid monosaccharide pentose-5-phosphate pyrimidone carboxylic acid derivative pyrimidine saccharide organic oxide organonitrogen compound organopnictogen compound imidolactam pyrimidine-6-carboxylic acid organoheterocyclic compound ribonucleoside 3'-phosphate alcohol carbonic acid derivative azacycle tetrahydrofuran heteroaromatic compound oxacycle monocarboxylic acid or derivatives organic oxygen compound phosphoric acid ester monoalkyl phosphate secondary alcohol hydrocarbon derivative primary amine organic nitrogen compound pyrimidine-6-carboxylic acid or derivatives organic phosphoric acid derivative amine alkyl phosphate organooxygen compound

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