Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:39:24 UTC
Update Date2025-03-21 17:58:23 UTC
HMDB IDHMDB0031416
Metabolite Identification
DeepMet IDDMID00014067
Name3,4-Dimethylheptane
Frequency314.5
Structure
Chemical FormulaC9H20
Molecular Mass128.1565
SMILESCCCC(C)C(C)CC
InChI KeyMAKRYGRRIKSDES-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasshydrocarbons
Classsaturated hydrocarbons
Subclass alkanes
Direct Parent branched alkanes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents Not Available
Substituents
  • aliphatic acyclic compound
  • branched alkane