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

Details

Stereochemistry MIXED
Molecular Formula C27H46O2
Molecular Weight 402.6529
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .DELTA.-TOCOPHEROL, DL-

SMILES

CC(C)CCCC(C)CCCC(C)CCCC1(C)CCC2=C(O1)C(C)=CC(O)=C2

InChI

InChIKey=GZIFEOYASATJEH-UHFFFAOYSA-N
InChI=1S/C27H46O2/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-16-27(6)17-15-24-19-25(28)18-23(5)26(24)29-27/h18-22,28H,7-17H2,1-6H3

HIDE SMILES / InChI

Molecular Formula C27H46O2
Molecular Weight 402.6529
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:08:52 GMT 2023
Edited
by admin
on Fri Dec 15 18:08:52 GMT 2023
Record UNII
ZL0RFA4E5N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.DELTA.-TOCOPHEROL, DL-
Common Name English
2H-1-BENZOPYRAN-6-OL, 3,4-DIHYDRO-2,8-DIMETHYL-2-(4,8,12-TRIMETHYLTRIDECYL)-
Systematic Name English
6-CHROMANOL, 2,8-DIMETHYL-2-(4,8,12-TRIMETHYLTRIDECYL)-
Systematic Name English
J816.832F
Code English
(±)-.DELTA.-TOCOPHEROL
Common Name English
Code System Code Type Description
PUBCHEM
586537
Created by admin on Fri Dec 15 18:08:52 GMT 2023 , Edited by admin on Fri Dec 15 18:08:52 GMT 2023
PRIMARY
CAS
5488-58-4
Created by admin on Fri Dec 15 18:08:52 GMT 2023 , Edited by admin on Fri Dec 15 18:08:52 GMT 2023
PRIMARY
FDA UNII
ZL0RFA4E5N
Created by admin on Fri Dec 15 18:08:52 GMT 2023 , Edited by admin on Fri Dec 15 18:08:52 GMT 2023
PRIMARY
EPA CompTox
DTXSID90859221
Created by admin on Fri Dec 15 18:08:52 GMT 2023 , Edited by admin on Fri Dec 15 18:08:52 GMT 2023
PRIMARY