Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:10 UTC
Update Date2025-03-25 00:54:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02203910
Frequency0.5
Structure
Chemical FormulaC10H12O5
Molecular Mass212.0685
SMILESOCC1(O)Cc2cc(O)cc(O)c2CO1
InChI KeyCLVLNNXDGDNKNV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 2-benzopyrans
Direct Parent 2-benzopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • alcohols and polyols
  • benzenoids
  • hemiacetals
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • alcohol
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • 2-benzopyran
  • hemiacetal
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound