Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:36:07 UTC
Update Date2025-03-21 22:51:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00571080
Frequency2.9
Structure
Chemical FormulaC9H20O
Molecular Mass144.1514
SMILESCCC(C)(CO)C(C)(C)C
InChI KeyKGXVBWQCXIDRBE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent alcohols and polyols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • hydrocarbon derivative