.ALPHA.-TOCOPHERYLOXYACETIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C31H52O4
Molecular Weight	488.7422
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of .ALPHA.-TOCOPHERYLOXYACETIC ACID

Structure Search

SMILES

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

InChI

InChIKey=LCFWOFKPFDWYLR-CEFNRUSXSA-N

InChI=1S/C31H52O4/c1-21(2)12-9-13-22(3)14-10-15-23(4)16-11-18-31(8)19-17-27-26(7)29(34-20-28(32)33)24(5)25(6)30(27)35-31/h21-23H,9-20H2,1-8H3,(H,32,33)/t22-,23-,31-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C31H52O4
Molecular Weight	488.7422
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 `Tue Apr 01 19:53:04 GMT 2025` Edited by `admin` on `Tue Apr 01 19:53:04 GMT 2025`
Record UNII	JW7FJR3ZLY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.ALPHA.-TEA

Preferred Name

English

.ALPHA.-TOCOPHERYLOXYACETIC ACID

Common Name

English

ALPHA-TOCOPHERYLOXYACETIC ACID

Common Name

English

ACETIC ACID, (((2R)-3,4-DIHYDRO-2,5,7,8-TETRAMETHYL-2-((4R,8R)-4,8,12-TRIMETHYLTRIDECYL)-2H-1-BENZOPYRAN-6-YL)OXY)-

Systematic Name

English

2,5,7,8-TETRAMETHYL-2R-(4R,8R,12-TRIMETHYLTRIDECYL)CHROMAN-6-YLOXYACETIC ACID

Systematic Name

English

ALPHA-TEA

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C129820