HEXASODIUM PHYTATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C6H12O24P6.6Na
Molecular Weight	791.9263
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].OP([O-])(=O)O[C@H]1[C@H](OP(O)([O-])=O)[C@@H](OP(O)([O-])=O)[C@H](OP(O)([O-])=O)[C@@H](OP(O)([O-])=O)[C@H]1OP(O)([O-])=O

InChI

InChIKey=DHZIAGCFFSRULK-BQYPOXACSA-H

InChI=1S/C6H18O24P6.6Na/c7-31(8,9)25-1-2(26-32(10,11)12)4(28-34(16,17)18)6(30-36(22,23)24)5(29-35(19,20)21)3(1)27-33(13,14)15;;;;;;/h1-6H,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)(H2,19,20,21)(H2,22,23,24);;;;;;/q;6*+1/p-6/t1-,2-,3-,4+,5-,6-;;;;;;

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	C6H12O24P6
Molecular Weight	653.9877
Charge	-6
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 07:55:20 UTC 2023` Edited by `admin` on `Sat Dec 16 07:55:20 UTC 2023`
Record UNII	ZBX50UG81V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

HEXASODIUM PHYTATE

Common Name

English

SNF-472

Code

English

(1R,2R,3S,4S,5R,6S)-CYCLOHEXANE-1,2,3,4,5,6-HEXAYL-HEXAKIS(DIHYDROGEN PHOSPHATE)

Systematic Name

English

INOSITOL, HEXAKIS(DIHYDROGEN PHOSPHATE) HEXASODIUM SALT, MYO-

Systematic Name

English

hexasodium fytate [INN]

Common Name

English

MYO-INOSITOL, HEXAKIS(DIHYDROGEN PHOSPHATE), HEXASODIUM SALT

Systematic Name

English

SNF472

Code

English

HEXASODIUM FYTATE

Official Name

English

Classification Tree Code System Code

FDA ORPHAN DRUG

380412