U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C48H82O2
Molecular Weight 691.1635
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CYCLOARTENYL OLEATE

SMILES

[H][C@@]1(CC[C@@]2(C)[C@]3([H])CC[C@]4([H])[C@]5(C[C@@]35CC[C@]12C)CC[C@H](OC(=O)CCCCCCC\C=C/CCCCCCCC)C4(C)C)[C@H](C)CCC=C(C)C

InChI

InChIKey=YKSMECKPLHKAFQ-FDDYDHHRSA-N
InChI=1S/C48H82O2/c1-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-43(49)50-42-31-33-47-36-48(47)35-34-45(7)39(38(4)26-24-25-37(2)3)30-32-46(45,8)41(48)29-28-40(47)44(42,5)6/h16-17,25,38-42H,9-15,18-24,26-36H2,1-8H3/b17-16-/t38-,39-,40+,41+,42+,45-,46+,47-,48+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
CYCLOARTENYL OLEATE
Common Name English
CYCLOARTENOL OLEATE
Common Name English
9,19-CYCLOLANOST-24-EN-3-OL, 9-OCTADECENOATE, (3.BETA.(Z))-
Systematic Name English
9,19-CYCLOLANOST-24-EN-3-OL, 3-(9Z)-9-OCTADECENOATE, (3.BETA.)-
Systematic Name English
Code System Code Type Description
FDA UNII
1RI3154EXY
Created by admin on Sat Dec 16 13:44:36 GMT 2023 , Edited by admin on Sat Dec 16 13:44:36 GMT 2023
PRIMARY
PUBCHEM
133082221
Created by admin on Sat Dec 16 13:44:36 GMT 2023 , Edited by admin on Sat Dec 16 13:44:36 GMT 2023
PRIMARY
CAS
137067-13-1
Created by admin on Sat Dec 16 13:44:36 GMT 2023 , Edited by admin on Sat Dec 16 13:44:36 GMT 2023
PRIMARY