Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:20:58 UTC
Update Date2025-03-21 18:36:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00112695
Frequency23.5
Structure
Chemical FormulaC16H24O3
Molecular Mass264.1725
SMILESCc1c(C)c2c(c(C)c1O)CCC(C)(CCCO)O2
InChI KeyGBDMZFNPKFKLCD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 1-benzopyrans
Direct Parent 1-benzopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alcohols and polyols
  • alkyl aryl ethers
  • benzenoids
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • alcohol
  • ether
  • 1-benzopyran
  • alkyl aryl ether
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound