Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:43 UTC
Update Date2025-03-25 00:48:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02168649
Frequency0.5
Structure
Chemical FormulaC15H28O5
Molecular Mass288.1937
SMILESCC(C)C(=O)OC1C(C)OC(C(O)O)C(C)C(C)C1C
InChI KeyFMYKBLPNLUGOCT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carbonyl hydrates
  • carboxylic acid esters
  • dialkyl ethers
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • carbonyl group
  • ether
  • carbonyl hydrate
  • carboxylic acid derivative
  • dialkyl ether
  • oxepane
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound