Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:18:38 UTC
Update Date2025-03-25 01:00:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02243917
Frequency0.5
Structure
Chemical FormulaC18H35O5PS
Molecular Mass394.1943
SMILESCCCCCCC=CCCCCCCCC(=O)SCCOP(=O)(O)O
InChI KeyIBHYUFKGDWALBV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acyl thioesters
Direct Parent fatty acyl thioesters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carbothioic s-esters
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • organic oxides
  • sulfenyl compounds
  • thioesters
  • thiolactones
  • Substituents
  • aliphatic acyclic compound
  • thiocarboxylic acid or derivatives
  • carbonyl group
  • sulfenyl compound
  • thiocarboxylic acid ester
  • organosulfur compound
  • carboxylic acid derivative
  • carbothioic s-ester
  • organic oxide
  • organic oxygen compound
  • phosphoric acid ester
  • monoalkyl phosphate
  • hydrocarbon derivative
  • fatty acyl thioester
  • thiolactone
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organooxygen compound