OXACYCLOHEXADEC-13-EN-2-ONE

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Keyword(s): Human Metabolites
Molecule Category Free-form
UNII GKS0KPO33V

Structure

InChI Key AGZBJJSLDGWKSU-CSKARUKUSA-N
Smiles O=C1OCCC=CCCCCCCCCCC1
InChI
InChI=1/C15H26O2/c16-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-17-15/h8,10H,1-7,9,11-14H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H26O2
Molecular Weight 238.19
AlogP 4.39
Hydrogen Bond Acceptor 2.0
Polar Surface Area 26.3
Heavy Atoms 17.0

Cross References

Resources Reference
CAS NUMBER 4941-78-0
NORMAN SUSDAT
FDA SRS GKS0KPO33V
PubChem 6436339
CONTENTS