DISODIUM ALPHA-TOCOPHERYL PHOSPHATE, DL-

Details

Stereochemistry	RACEMIC
Molecular Formula	C29H49O5P.2Na
Molecular Weight	554.6497
Optical Activity	( + / - )
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DISODIUM ALPHA-TOCOPHERYL PHOSPHATE, DL-

Structure Search

SMILES

[Na+].[Na+].CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@]1(C)CCC2=C(O1)C(C)=C(C)C(OP([O-])([O-])=O)=C2C

InChI

InChIKey=LPWACMVJQSCQOF-RQGAJXLPSA-L

InChI=1S/C29H51O5P.2Na/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8)19-17-26-25(7)27(34-35(30,31)32)23(5)24(6)28(26)33-29;;/h20-22H,9-19H2,1-8H3,(H2,30,31,32);;/q;2*+1/p-2/t21-,22-,29-;;/m1../s1

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C29H49O5P
Molecular Weight	508.6701
Charge	-2
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 08:01:44 UTC 2023` Edited by `admin` on `Sat Dec 16 08:01:44 UTC 2023`
Record UNII	35ZC9LRM4U
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DISODIUM ALPHA-TOCOPHERYL PHOSPHATE, DL-

Common Name

English

2H-1-BENZOPYRAN-6-OL, 3,4-DIHYDRO-2,5,7,8-TETRAMETHYL-2-((4R,8R)-4,8,12-TRIMETHYLTRIDECYL)-, 6-(DIHYDROGEN PHOSPHATE), SODIUM SALT (1:2), (2R)-REL-

Systematic Name

English

DL-.ALPHA.-TOCOPHEROL DISODIUM PHOSPHATE

Common Name

English

2H-1-BENZOPYRAN-6-OL, 3,4-DIHYDRO-2,5,7,8-TETRAMETHYL-2-(4,8,12-TRIMETHYLTRIDECYL)-, DIHYDROGEN PHOSPHATE, DISODIUM SALT, (2R*(4R*,8R*))-(±)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID60433037

Created by admin on Sat Dec 16 08:01:44 UTC 2023 , Edited by admin on Sat Dec 16 08:01:44 UTC 2023

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CAS

60934-46-5

Created by admin on Sat Dec 16 08:01:44 UTC 2023 , Edited by admin on Sat Dec 16 08:01:44 UTC 2023

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PUBCHEM

18391755

Created by admin on Sat Dec 16 08:01:44 UTC 2023 , Edited by admin on Sat Dec 16 08:01:44 UTC 2023

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FDA UNII

35ZC9LRM4U

Created by admin on Sat Dec 16 08:01:44 UTC 2023 , Edited by admin on Sat Dec 16 08:01:44 UTC 2023

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Related Record Type Details


					7D2U5UV9RA

DISODIUM .ALPHA.-TOCOPHERYL PHOSPHATE, D-

ENANTIOMER -> RACEMATE

Amount: