Hmdb loader

Showing information for DMID02149758

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:25 UTC
Update Date2025-03-25 00:45:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02149758
Frequency0.5
Structure
Chemical FormulaC33H54O9
Molecular Mass594.3768
SMILESCC1CCC(C(C)C2CCC3C4C(O)CC5CC(OC6OC(C(=O)O)C(O)C(O)C6O)CCC5(C)C4CC(O)C23C)C1
InChI KeyLEHAYIXRGVVHBK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsteroids and steroid derivatives
Subclass steroidal glycosides
Direct Parent steroid glucuronide conjugates
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 12-hydroxysteroids
  • 7-hydroxysteroids
  • acetals
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • cyclic alcohols and derivatives
  • diterpene glycosides
  • diterpenoids
  • glucuronic acid derivatives
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monosaccharides
  • o-glucuronides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • pregnane steroids
  • pyran carboxylic acids
  • secondary alcohols
    • Substituents
  • carbonyl group
  • 12-hydroxysteroid
  • carboxylic acid
  • glucuronic acid or derivatives
  • abietane diterpenoid
  • o-glucuronide
  • monosaccharide
  • carboxylic acid derivative
  • pyran carboxylic acid
  • diterpene glycoside
  • 1-o-glucuronide
  • aliphatic heteropolycyclic compound
  • beta-hydroxy acid
  • saccharide
  • organic oxide
  • acetal
  • oxane
  • organoheterocyclic compound
  • alcohol
  • pyran carboxylic acid or derivatives
  • hydroxysteroid
  • terpene glycoside
  • hydroxy acid
  • cyclic alcohol
  • 7-hydroxysteroid
  • oxacycle
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • pyran
  • secondary alcohol
  • steroid-glucuronide-skeleton
  • hydrocarbon derivative
  • diterpenoid
  • pregnane-skeleton
  • organooxygen compound