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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H44O2
Molecular Weight 388.6264
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TOCOL, (2S)-

SMILES

CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@@]1(C)CCC2=CC(O)=CC=C2O1

InChI

InChIKey=DFUSDJMZWQVQSF-DRLORSAXSA-N
InChI=1S/C26H44O2/c1-20(2)9-6-10-21(3)11-7-12-22(4)13-8-17-26(5)18-16-23-19-24(27)14-15-25(23)28-26/h14-15,19-22,27H,6-13,16-18H2,1-5H3/t21-,22-,26+/m1/s1

HIDE SMILES / InChI

Molecular Formula C26H44O2
Molecular Weight 388.6264
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:25:30 GMT 2023
Edited
by admin
on Sat Dec 16 08:25:30 GMT 2023
Record UNII
PIZ4C71R1M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TOCOL, (2S)-
Common Name English
2H-1-BENZOPYRAN-6-OL, 3,4-DIHYDRO-2-METHYL-2-(4,8,12-TRIMETHYLTRIDECYL)-, (2S-(2R*(4S*,8S*)))-
Systematic Name English
Code System Code Type Description
FDA UNII
PIZ4C71R1M
Created by admin on Sat Dec 16 08:25:30 GMT 2023 , Edited by admin on Sat Dec 16 08:25:30 GMT 2023
PRIMARY
CAS
131321-19-2
Created by admin on Sat Dec 16 08:25:30 GMT 2023 , Edited by admin on Sat Dec 16 08:25:30 GMT 2023
PRIMARY
PUBCHEM
11760913
Created by admin on Sat Dec 16 08:25:30 GMT 2023 , Edited by admin on Sat Dec 16 08:25:30 GMT 2023
PRIMARY