DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:14:32 UTC
Update Date	2025-03-21 18:33:40 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00096927
Frequency	28.5
Structure
Chemical Formula	C₁₀H₁₄N₂O₁₄P₂
Molecular Mass	447.992
SMILES	O=C(O)c1cc(=O)[nH]c(=O)n1C1OC(COP(=O)(O)O)C(O)C1OP(=O)(O)O
InChI Key	OQUPKKOKIPAWGC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	pyrimidine nucleotides
Subclass	pyrimidine ribonucleotides
Direct Parent	pyrimidine ribonucleoside 2',5'-bisphosphates
Geometric Descriptor	aromatic heteromonocyclic compounds
Alternative Parents	azacyclic compounds carboxylic acids heteroaromatic compounds hydrocarbon derivatives lactams monoalkyl phosphates monocarboxylic acids and derivatives monosaccharides organic carbonic acids and derivatives organic oxides organonitrogen compounds organopnictogen compounds oxacyclic compounds pentose phosphates pyrimidine nucleosides pyrimidinecarboxylic acids pyrimidones secondary alcohols tetrahydrofurans vinylogous amides
Substituents	lactam carboxylic acid aromatic heteromonocyclic compound pentose phosphate monosaccharide pentose-5-phosphate pyrimidone carboxylic acid derivative pyrimidine pyrimidine ribonucleoside 2',5'-bisphosphate saccharide organic oxide organonitrogen compound organopnictogen compound pyrimidine nucleoside pyrimidine-6-carboxylic acid organoheterocyclic compound alcohol vinylogous amide carbonic acid derivative azacycle tetrahydrofuran heteroaromatic compound oxacycle monocarboxylic acid or derivatives organic oxygen compound phosphoric acid ester monoalkyl phosphate secondary alcohol hydrocarbon derivative organic nitrogen compound pyrimidine-6-carboxylic acid or derivatives organic phosphoric acid derivative alkyl phosphate organooxygen compound

Showing information for DMID00096927