Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:20:45 UTC
Update Date2025-03-21 18:36:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00112176
Frequency23.7
Structure
Chemical FormulaC16H26
Molecular Mass218.2035
SMILESCCCCCCCCc1c(C)cccc1C
InChI KeyPSQKBJAHTKZJFY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass xylenes
Direct Parent m-xylenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • saturated hydrocarbons
  • Substituents
  • aromatic homomonocyclic compound
  • saturated hydrocarbon
  • m-xylene
  • hydrocarbon