Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:52 UTC
Update Date2025-03-25 00:45:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150824
Frequency0.5
Structure
Chemical FormulaC7H11O6P
Molecular Mass222.0293
SMILESCC1=C(COP(=O)(O)O)C(=O)OC1C
InChI KeyDEBAEQUCBHGRBC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic phosphoric acids and derivatives
Subclass phosphate esters
Direct Parent monoalkyl phosphates
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • butenolides
  • carbonyl compounds
  • dihydrofurans
  • enoate esters
  • hydrocarbon derivatives
  • lactones
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • enoate ester
  • carbonyl group
  • carboxylic acid derivative
  • lactone
  • oxacycle
  • alpha,beta-unsaturated carboxylic ester
  • 2-furanone
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • monoalkyl phosphate
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound
  • dihydrofuran