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Details

Stereochemistry RACEMIC
Molecular Formula C16H22O5
Molecular Weight 294.3429
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-TOCOPHERONIC ACID

SMILES

CC1=C(C)C(=O)C(CCC(C)(O)CCC(O)=O)=C(C)C1=O

InChI

InChIKey=LRYFTDGIIUTFFA-UHFFFAOYSA-N
InChI=1S/C16H22O5/c1-9-10(2)15(20)12(11(3)14(9)19)5-7-16(4,21)8-6-13(17)18/h21H,5-8H2,1-4H3,(H,17,18)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
TOCOPHERONIC ACID, ALPHA-
Preferred Name English
.ALPHA.-TOCOPHERONIC ACID
Common Name English
1,4-CYCLOHEXADIENE-1-HEXANOIC ACID, .GAMMA.-HYDROXY-.GAMMA.,2,4,5-TETRAMETHYL-3,6-DIOXO-
Systematic Name English
.GAMMA.-HYDROXY-.GAMMA.,2,4,5-TETRAMETHYL-3,6-DIOXO-1,4-CYCLOHEXADIENE-1-HEXANOIC ACID
Systematic Name English
4-HYDROXY-4-METHYL-6-(2,4,5-TRIMETHYL-3,6-DIOXO-CYCLOHEXA-1,4-DIEN-1-YL)HEXANOIC ACID
Systematic Name English
Code System Code Type Description
FDA UNII
V16HYX6K7B
Created by admin on Mon Mar 31 22:16:33 GMT 2025 , Edited by admin on Mon Mar 31 22:16:33 GMT 2025
PRIMARY
CAS
1948-76-1
Created by admin on Mon Mar 31 22:16:33 GMT 2025 , Edited by admin on Mon Mar 31 22:16:33 GMT 2025
PRIMARY
EPA CompTox
DTXSID401144623
Created by admin on Mon Mar 31 22:16:33 GMT 2025 , Edited by admin on Mon Mar 31 22:16:33 GMT 2025
PRIMARY
PUBCHEM
67764516
Created by admin on Mon Mar 31 22:16:33 GMT 2025 , Edited by admin on Mon Mar 31 22:16:33 GMT 2025
PRIMARY
NIH
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