Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:13 UTC
Update Date2025-03-25 01:00:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02245281
Frequency0.5
Structure
Chemical FormulaC31H56
Molecular Mass428.4382
SMILESCCCCCCCCCCCCCCCCCCCCCCCc1cccc(C)c1C
InChI KeyOEHCOASTABECRH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass xylenes
Direct Parent o-xylenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • saturated hydrocarbons
  • Substituents
  • aromatic homomonocyclic compound
  • saturated hydrocarbon
  • o-xylene
  • hydrocarbon