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Details

Stereochemistry ACHIRAL
Molecular Formula C20H36O5S
Molecular Weight 388.562
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of LINOLEOYL ISETHIONIC ACID

SMILES

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

InChI

InChIKey=YMKGDEDSSWIOGB-HZJYTTRNSA-N
InChI=1S/C20H36O5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(21)25-18-19-26(22,23)24/h6-7,9-10H,2-5,8,11-19H2,1H3,(H,22,23,24)/b7-6-,10-9-

HIDE SMILES / InChI

Molecular Formula C20H36O5S
Molecular Weight 388.562
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:06:20 GMT 2023
Edited
by admin
on Sat Dec 16 18:06:20 GMT 2023
Record UNII
36QTX5X9BB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LINOLEOYL ISETHIONIC ACID
Common Name English
LINOLEOYL ISETHIONATE
Common Name English
9,12-OCTADECADIENOIC ACID (9Z,12Z)-, 2-SULFOETHYL ESTER
Systematic Name English
2-SULFOETHYL (9Z,12Z)-9,12-OCTADECADIENOATE
Systematic Name English
Code System Code Type Description
FDA UNII
36QTX5X9BB
Created by admin on Sat Dec 16 18:06:20 GMT 2023 , Edited by admin on Sat Dec 16 18:06:20 GMT 2023
PRIMARY
PUBCHEM
56841701
Created by admin on Sat Dec 16 18:06:20 GMT 2023 , Edited by admin on Sat Dec 16 18:06:20 GMT 2023
PRIMARY
CAS
1021986-93-5
Created by admin on Sat Dec 16 18:06:20 GMT 2023 , Edited by admin on Sat Dec 16 18:06:20 GMT 2023
PRIMARY
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