Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:45:00 UTC
Update Date2025-03-21 18:00:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00026679
Frequency143.0
Structure
Chemical FormulaC25H40O7
Molecular Mass452.2774
SMILESCC1OC(OC2CCC3(C)C(CCC4C5CCC(=O)C5(C)CC(O)C43)C2)C(O)C(O)C1O
InChI KeyKHHDTSUTXKOHTE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsteroids and steroid derivatives
Subclass steroidal glycosides
Direct Parent steroidal glycosides
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 11-hydroxysteroids
  • 17-oxosteroids
  • acetals
  • androstane steroids
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • ketones
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • oxosteroid
  • steroidal glycoside
  • monosaccharide
  • hydroxysteroid
  • cyclic alcohol
  • ketone
  • aliphatic heteropolycyclic compound
  • oxacycle
  • saccharide
  • organic oxide
  • organic oxygen compound
  • androstane-skeleton
  • acetal
  • secondary alcohol
  • 17-oxosteroid
  • hydrocarbon derivative
  • 11-hydroxysteroid
  • oxane
  • organoheterocyclic compound
  • organooxygen compound