Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:49:28 UTC
Update Date2025-03-21 18:02:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00037317
Frequency94.4
Structure
Chemical FormulaC8H15O5P
Molecular Mass222.0657
SMILESCCCCCC=CC(=O)OP(=O)(O)O
InChI KeyVQSNFZCOLPGGEH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic phosphoric acids and derivatives
Subclass phosphate esters
Direct Parent acyl monophosphates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organic phosphoric acids and derivatives
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • acyl monophosphate
  • hydrocarbon derivative
  • carboxylic acid derivative
  • organooxygen compound