Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:00 UTC
Update Date2025-03-21 18:38:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00122374
Frequency21.1
Structure
Chemical FormulaC12H15N
Molecular Mass173.1204
SMILESCc1[nH]c2c(C)ccc(C)c2c1C
InChI KeyTVGROLOWIKMJFV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent 3-methylindoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • indoles
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • Substituents
  • 3-methylindole
  • azacycle
  • heteroaromatic compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound