CHENYLGLYCINE SODIUM

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H42NO5.Na
Molecular Weight	471.6051
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].[H][C@@]1(CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)NCC([O-])=O

InChI

InChIKey=AAYACJGHNRIFCT-YRJJIGPTSA-M

InChI=1S/C26H43NO5.Na/c1-15(4-7-22(30)27-14-23(31)32)18-5-6-19-24-20(9-11-26(18,19)3)25(2)10-8-17(28)12-16(25)13-21(24)29;/h15-21,24,28-29H,4-14H2,1-3H3,(H,27,30)(H,31,32);/q;+1/p-1/t15-,16+,17-,18-,19+,20+,21-,24+,25+,26-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C26H42NO5
Molecular Weight	448.6154
Charge	-1
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 10
E/Z Centers	0
Optical Activity	UNSPECIFIED

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:48:58 UTC 2023` Edited by `admin` on `Fri Dec 15 15:48:58 UTC 2023`
Record UNII	OK5NH65A9B
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CHENYLGLYCINE SODIUM

Common Name

English

GLYCINE, N-((3.ALPHA.,5.BETA.,7.ALPHA.)-3,7-DIHYDROXY-24-OXOCHOLAN-24-YL)-, SODIUM SALT (1:1)

Systematic Name

English

GLYCOCHENODEOXYCHOLIC ACID SODIUM SALT

Common Name

English

SODIUM GLYCOCHENODEOXYCHOLATE

Common Name

English

SODIUM GLYCYLCHENODEOXYCHOLATE

Common Name

English

SODIUM CHENODEOXYCHOLYLGLYCINE

Common Name

English

NSC-681056

Code

English

SODIUM GLYCOCHENODESOXYCHOLATE

Common Name

English

Code System Code Type Description

NSC

681056