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Details

Stereochemistry MIXED
Molecular Formula C40H76
Molecular Weight 557.0314
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 4
E/Z Centers 3
Charge 0

SHOW SMILES / InChI
Structure of (12E,14E,18E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-12,14,18-triene

SMILES

CC(C)CCCC(C)CCCC(C)CCC\C(C)=C\CC\C=C(C)\C=C\CC(C)CCCC(C)CCCC(C)C

InChI

InChIKey=ZIXCQUUPXRSTEB-VJRWTCCYSA-N
InChI=1S/C40H76/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h15,21-22,25,33-34,37-40H,11-14,16-20,23-24,26-32H2,1-10H3/b25-15+,35-21+,36-22+

HIDE SMILES / InChI

Molecular Formula C40H76
Molecular Weight 557.0314
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 4
E/Z Centers 3
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:30:57 GMT 2025
Edited
by admin
on Wed Apr 02 17:30:57 GMT 2025
Record UNII
KE8JVS9BFB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(12E,14E,18E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-12,14,18-triene
Common Name English
(all-RS,all-E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-12,14,18-triene.
Preferred Name English
all-rac-?-TOCOPHERYL ACETATE IMPURITY E [EP IMPURITY]
Common Name English
Code System Code Type Description
FDA UNII
KE8JVS9BFB
Created by admin on Wed Apr 02 17:30:57 GMT 2025 , Edited by admin on Wed Apr 02 17:30:57 GMT 2025
PRIMARY
PUBCHEM
71751284
Created by admin on Wed Apr 02 17:30:57 GMT 2025 , Edited by admin on Wed Apr 02 17:30:57 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY