(2R)-2-HYDROXYOCTADECANOIC ACID

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

Structure

InChI Key KIHBGTRZFAVZRV-QGZVFWFLSA-N
Smiles CCCCCCCCCCCCCCCC[C@@H](O)C(O)=O
InChI
InChI=1S/C18H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(19)18(20)21/h17,19H,2-16H2,1H3,(H,20,21)/t17-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H36O3
Molecular Weight 300.27
AlogP 5.3
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 16.0
Polar Surface Area 57.53
Heavy Atoms 21.0

Cross References

Resources Reference
CAS NUMBER 26633-48-7
NORMAN SUSDAT
CONTENTS