.BETA.-TOCOPHEROL

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C28H48O2
Molecular Weight	416.6795
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of .BETA.-TOCOPHEROL

Structure Search

SMILES

CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@]1(C)CCC2=C(O1)C(C)=CC(O)=C2C

InChI

InChIKey=WGVKWNUPNGFDFJ-DQCZWYHMSA-N

InChI=1S/C28H48O2/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-17-28(7)18-16-25-24(6)26(29)19-23(5)27(25)30-28/h19-22,29H,8-18H2,1-7H3/t21-,22-,28-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C28H48O2
Molecular Weight	416.6795
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 `Fri Dec 15 15:00:25 UTC 2023` Edited by `admin` on `Fri Dec 15 15:00:25 UTC 2023`
Record UNII	9U6A490501
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.BETA.-TOCOPHEROL

Common Name

English

.BETA.-TOCOPHEROL [MI]

Common Name

English

CUMOTOCOPHEROL

Common Name

English

Beta tocopherol [WHO-DD]

Common Name

English

RRR-.ALPHA.-TOCOPHEROL IMPURITY B [EP IMPURITY]

Common Name

English

VITAMIN E (BETA TOCOTRIENOL)

Common Name

English

BETA TOCOPHEROL

Common Name

English

BETA-TOCOPHEROL (CONSTITUENT OF LYCOPENE AND TOMATO EXTRACT CONTAINING LYCOPENE) [DSC]

Common Name

English

5,8-DIMETHYLTOCOL

Common Name

English

P-XYLOTOCOPHEROL

Common Name

English

(+)-2,5,8-TRIMETHYL-2-(4,8,12-TRIMETHYLTRIDECYL)-6-CHROMANOL

Systematic Name

English

(2R)-3,4-DIHYDRO-2,5,8-TRIMETHYL-2-((4R,8R)-4,8,12-TRIMETHYLTRIDECYL)-2H-1-BENZOPYRAN-6-OL

Systematic Name

English

2H-1-BENZOPYRAN-6-OL, 3,4-DIHYDRO-2,5,8-TRIMETHYL-2-((4R,8R)-4,8,12-TRIMETHYLTRIDECYL)-, (2R)-

Systematic Name

English

BETA-TOCOPHEROL

Common Name

English

J236.825K

Code

English

RRR-.BETA.-TOCOPHEROL

Common Name

English

D-.BETA.-TOCOPHEROL

Common Name

English

Classification Tree Code System Code

DSLD

3276 (Number of products:52)

Created by admin on Fri Dec 15 15:00:25 UTC 2023 , Edited by admin on Fri Dec 15 15:00:25 UTC 2023

DSLD

2493 (Number of products:67)

Created by admin on Fri Dec 15 15:00:25 UTC 2023 , Edited by admin on Fri Dec 15 15:00:25 UTC 2023

NCI_THESAURUS

C68313

Created by admin on Fri Dec 15 15:00:25 UTC 2023 , Edited by admin on Fri Dec 15 15:00:25 UTC 2023

Code System Code Type Description

WIKIPEDIA

BETA-TOCOPHEROL

Created by admin on Fri Dec 15 15:00:25 UTC 2023 , Edited by admin on Fri Dec 15 15:00:25 UTC 2023

PRIMARY

ECHA (EC/EINECS)

240-747-1

Created by admin on Fri Dec 15 15:00:25 UTC 2023 , Edited by admin on Fri Dec 15 15:00:25 UTC 2023

PRIMARY

CAS

148-03-8

Created by admin on Fri Dec 15 15:00:25 UTC 2023 , Edited by admin on Fri Dec 15 15:00:25 UTC 2023

NON-SPECIFIC STEREOCHEMISTRY

CAS

16698-35-4

Created by admin on Fri Dec 15 15:00:25 UTC 2023 , Edited by admin on Fri Dec 15 15:00:25 UTC 2023

PRIMARY

SMS_ID

300000013820

Created by admin on Fri Dec 15 15:00:25 UTC 2023 , Edited by admin on Fri Dec 15 15:00:25 UTC 2023

PRIMARY

RXCUI

1792723

Created by admin on Fri Dec 15 15:00:25 UTC 2023 , Edited by admin on Fri Dec 15 15:00:25 UTC 2023

PRIMARY

PUBCHEM

6857447

Created by admin on Fri Dec 15 15:00:25 UTC 2023 , Edited by admin on Fri Dec 15 15:00:25 UTC 2023

PRIMARY

ECHA (EC/EINECS)

205-708-5

Created by admin on Fri Dec 15 15:00:25 UTC 2023 , Edited by admin on Fri Dec 15 15:00:25 UTC 2023

ALTERNATIVE

CHEBI

47771

Created by admin on Fri Dec 15 15:00:25 UTC 2023 , Edited by admin on Fri Dec 15 15:00:25 UTC 2023

PRIMARY

NCI_THESAURUS

C68315

Created by admin on Fri Dec 15 15:00:25 UTC 2023 , Edited by admin on Fri Dec 15 15:00:25 UTC 2023

PRIMARY

EPA CompTox

DTXSID30884931

Created by admin on Fri Dec 15 15:00:25 UTC 2023 , Edited by admin on Fri Dec 15 15:00:25 UTC 2023

PRIMARY

MERCK INDEX

m10924

Created by admin on Fri Dec 15 15:00:25 UTC 2023 , Edited by admin on Fri Dec 15 15:00:25 UTC 2023

PRIMARY

Merck Index

FDA UNII

9U6A490501

Created by admin on Fri Dec 15 15:00:25 UTC 2023 , Edited by admin on Fri Dec 15 15:00:25 UTC 2023

PRIMARY

DAILYMED

9U6A490501

Created by admin on Fri Dec 15 15:00:25 UTC 2023 , Edited by admin on Fri Dec 15 15:00:25 UTC 2023

PRIMARY

Related Record Type Details


					N9PR3490H9

.ALPHA.-TOCOPHEROL, D-

PARENT -> IMPURITY

Comments:

UNSPECIFIED

Interaction Type:

CHROMATOGRAPHIC PURITY (GC)

Qualification:

EP