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

Details

Stereochemistry ACHIRAL
Molecular Formula C20H38O2S
Molecular Weight 342.58
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of MERCAPTOETHYL OLEATE

SMILES

CCCCCCCC\C=C/CCCCCCCC(=O)OCCS

InChI

InChIKey=WEMJWKKJHSZRQT-KTKRTIGZSA-N
InChI=1S/C20H38O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(21)22-18-19-23/h9-10,23H,2-8,11-19H2,1H3/b10-9-

HIDE SMILES / InChI

Approval Year

Name Type Language
MERCAPTOETHYL OLEATE
Systematic Name English
9-OCTADECENOIC ACID (9Z)-, 2-MERCAPTOETHYL ESTER
Systematic Name English
2-MERCAPTOETHYL OLEATE
Systematic Name English
OLEIC ACID 2-MERCAPTOETHYL ESTER
Systematic Name English
J308.621F
Code English
(Z)-9-OCTADECENOIC ACID 2-MERCAPTOETHYL ESTER
Systematic Name English
9-OCTADECENOIC ACID (Z)-, 2-MERCAPTOETHYL ESTER
Systematic Name English
Code System Code Type Description
CAS
59118-78-4
Created by admin on Sat Dec 16 08:02:00 GMT 2023 , Edited by admin on Sat Dec 16 08:02:00 GMT 2023
PRIMARY
PUBCHEM
6436848
Created by admin on Sat Dec 16 08:02:00 GMT 2023 , Edited by admin on Sat Dec 16 08:02:00 GMT 2023
PRIMARY
ECHA (EC/EINECS)
261-609-7
Created by admin on Sat Dec 16 08:02:00 GMT 2023 , Edited by admin on Sat Dec 16 08:02:00 GMT 2023
PRIMARY
EPA CompTox
DTXSID4028048
Created by admin on Sat Dec 16 08:02:00 GMT 2023 , Edited by admin on Sat Dec 16 08:02:00 GMT 2023
PRIMARY
FDA UNII
BDJ7C8GBWL
Created by admin on Sat Dec 16 08:02:00 GMT 2023 , Edited by admin on Sat Dec 16 08:02:00 GMT 2023
PRIMARY