Structure

InChI Key SSQPWTVBQMWLSZ-AAQCHOMXSA-N
Smiles CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OCC
InChI
InChI=1S/C22H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24-4-2/h5-6,8-9,11-12,14-15,17-18H,3-4,7,10,13,16,19-21H2,1-2H3/b6-5-,9-8-,12-11-,15-14-,18-17-

Physicochemical Descriptors

Property Name Value
Molecular Formula C22H34O2
Molecular Weight 330.51
AlogP 6.47
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 14.0
Polar Surface Area 26.3
Molecular species None
Aromatic Rings 0.0
Heavy Atoms 24.0

Related Entries

Cross References

Resources Reference
ChEBI 84883
ChEMBL CHEMBL2095209
DrugBank DB08887
DrugCentral 1413
FDA SRS 6GC8A4PAYH
Human Metabolome Database HMDB0039530
Guide to Pharmacology 7441
KEGG C16184
PubChem 9831415
SureChEMBL SCHEMBL123305
ZINC ZINC000003785276