DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:38:24 UTC
Update Date	2025-03-25 00:45:55 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02152066
Frequency	0.5
Structure
Chemical Formula	C₁₃H₁₉N₄O₁₁P
Molecular Mass	438.0788
SMILES	NC(CC(=O)Nc1ccn(C2OC(CO)C(OP(=O)(O)O)C2O)c(=O)n1)C(=O)O
InChI Key	GDESHIYOOVFIRH-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	alpha amino acids asparagine and derivatives azacyclic compounds carbonyl compounds carboxylic acids fatty amides heteroaromatic compounds hydrocarbon derivatives imidolactams monoalkyl phosphates monoalkylamines monocarboxylic acids and derivatives monosaccharides n-arylamides organic carbonic acids and derivatives organic oxides organopnictogen compounds oxacyclic compounds pentose phosphates primary alcohols pyrimidones secondary alcohols secondary carboxylic acid amides tetrahydrofurans
Substituents	fatty acyl carbonyl group carboxylic acid aromatic heteromonocyclic compound pentose phosphate fatty amide monosaccharide pyrimidone n-arylamide alpha-amino acid or derivatives carboxylic acid derivative pyrimidine saccharide organic oxide organonitrogen compound alpha-amino acid organopnictogen compound asparagine or derivatives primary alcohol imidolactam organoheterocyclic compound ribonucleoside 3'-phosphate alcohol carbonic acid derivative azacycle tetrahydrofuran heteroaromatic compound carboxamide group oxacycle secondary carboxylic acid amide monocarboxylic acid or derivatives organic oxygen compound phosphoric acid ester monoalkyl phosphate secondary alcohol hydrocarbon derivative primary aliphatic amine organic nitrogen compound organic phosphoric acid derivative alkyl phosphate organooxygen compound

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