Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:20:46 UTC
Update Date2025-03-21 18:36:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00112220
Frequency23.7
Structure
Chemical FormulaC6H14NO6P
Molecular Mass227.0559
SMILESNCCCCC(OP(=O)(O)O)C(=O)O
InChI KeyKWVCUHGRLZLALC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass medium-chain hydroxy acids and derivatives
Direct Parent medium-chain hydroxy acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • medium-chain fatty acids
  • monoalkyl phosphates
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • fatty acid
  • carboxylic acid derivative
  • medium-chain hydroxy acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • phosphoric acid ester
  • monoalkyl phosphate
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • medium-chain fatty acid
  • primary aliphatic amine
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organooxygen compound