Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:26 UTC
Update Date2025-03-25 00:59:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02236583
Frequency0.5
Structure
Chemical FormulaC18H20O9
Molecular Mass380.1107
SMILESCOc1cc(C2OC(=O)C(OC(C)=O)C3COC(=O)C23)cc(OC)c1OC
InChI KeyXGSWGGFSRGEUDX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfuropyrans
Subclass furopyrans
Direct Parent furopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • carbonyl compounds
  • carboxylic acid esters
  • delta valerolactones
  • furans
  • gamma butyrolactones
  • hydrocarbon derivatives
  • methoxybenzenes
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • phenoxy compounds
  • pyrans
  • tetrahydrofurans
  • tricarboxylic acids and derivatives
  • Substituents
  • furan
  • phenol ether
  • monocyclic benzene moiety
  • carbonyl group
  • ether
  • delta valerolactone
  • tricarboxylic acid or derivatives
  • alkyl aryl ether
  • carboxylic acid derivative
  • lactone
  • organic oxide
  • aromatic heteropolycyclic compound
  • oxane
  • delta_valerolactone
  • tetrahydrofuran
  • furopyran
  • methoxybenzene
  • gamma butyrolactone
  • oxacycle
  • organic oxygen compound
  • pyran
  • anisole
  • carboxylic acid ester
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • organooxygen compound