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

Structure

InChI Key MTOIBIYGZXVBJA-UHFFFAOYSA-N
Smiles OC1CCCCC23CC12CC3
InChI
InChI=1S/C10H16O/c11-8-3-1-2-4-9-5-6-10(8,9)7-9/h8,11H,1-7H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H16O1
Molecular Weight 152.12
AlogP 2.09
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Polar Surface Area 20.23
Heavy Atoms 11.0

Cross References

Resources Reference
NORMAN SUSDAT