DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:22:47 UTC
Update Date	2025-03-25 01:02:03 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02253432
Frequency	0.5
Structure
Chemical Formula	C₁₀H₁₅N₃O₉P+
Molecular Mass	352.054
SMILES	Nc1ncc(C(=O)O)c[n+]1C1OC(COP(=O)(O)O)C(O)C1O
InChI Key	WEXUVNDLNRDVDJ-UHFFFAOYSA-O
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	pyrimidine nucleotides
Subclass	pyrimidine ribonucleotides
Direct Parent	pyrimidine ribonucleoside monophosphates
Geometric Descriptor	aromatic heteromonocyclic compounds
Alternative Parents	1,2-diols amino acids azacyclic compounds carboxylic acids heteroaromatic compounds hydrocarbon derivatives monoalkyl phosphates monocarboxylic acids and derivatives monosaccharides organic cations organic oxides organopnictogen compounds oxacyclic compounds pentose phosphates primary amines pyrimidinecarboxylic acids secondary alcohols tetrahydrofurans vinylogous amides
Substituents	carboxylic acid aromatic heteromonocyclic compound pentose phosphate amino acid or derivatives amino acid monosaccharide pentose-5-phosphate carboxylic acid derivative pyrimidine saccharide organic oxide organonitrogen compound organopnictogen compound organic cation organoheterocyclic compound 1,2-diol alcohol vinylogous amide azacycle tetrahydrofuran heteroaromatic compound pyrimidine-5-carboxylic acid or derivatives pyrimidine-5-carboxylic acid oxacycle pyrimidine ribonucleoside monophosphate monocarboxylic acid or derivatives organic oxygen compound phosphoric acid ester monoalkyl phosphate secondary alcohol hydrocarbon derivative primary amine organic nitrogen compound organic phosphoric acid derivative amine alkyl phosphate organooxygen compound

Showing information for DMID02253432