SODIUM 1-((1,1'-BIPHENYL)-4-YLHYDROXYAMINO)-1-DEOXY-.BETA.-D-GLUCOPYRANURONATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H18NO7.Na
Molecular Weight	383.3278
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of SODIUM 1-((1,1'-BIPHENYL)-4-YLHYDROXYAMINO)-1-DEOXY-.BETA.-D-GLUCOPYRANURONATE

Structure Search

SMILES

[Na+].O[C@@H]1[C@@H](O)[C@@H](O[C@@H]([C@H]1O)C([O-])=O)N(O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChIKey=CALIBSYELOAUMC-LXLGGMPYSA-M

InChI=1S/C18H19NO7.Na/c20-13-14(21)16(18(23)24)26-17(15(13)22)19(25)12-8-6-11(7-9-12)10-4-2-1-3-5-10;/h1-9,13-17,20-22,25H,(H,23,24);/q;+1/p-1/t13-,14-,15+,16-,17+;/m0./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	C18H18NO7
Molecular Weight	360.338
Charge	-1
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:50:43 GMT 2023` Edited by `admin` on `Sat Dec 16 10:50:43 GMT 2023`
Record UNII	631Q456SY5
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

SODIUM 1-((1,1'-BIPHENYL)-4-YLHYDROXYAMINO)-1-DEOXY-.BETA.-D-GLUCOPYRANURONATE

Common Name

English

MONOSODIUM 1-((1,1'-BIPHENYL)-4-YLHYDROXYAMINO)-1-DEOXYBETA-D-GLUCOPYRANURONATE

Common Name

English

Code System Code Type Description

PUBCHEM

23694675

Created by admin on Sat Dec 16 10:50:43 GMT 2023 , Edited by admin on Sat Dec 16 10:50:43 GMT 2023

PRIMARY

FDA UNII

631Q456SY5

Created by admin on Sat Dec 16 10:50:43 GMT 2023 , Edited by admin on Sat Dec 16 10:50:43 GMT 2023

PRIMARY

EPA CompTox

DTXSID50982746

Created by admin on Sat Dec 16 10:50:43 GMT 2023 , Edited by admin on Sat Dec 16 10:50:43 GMT 2023

PRIMARY

CAS

64201-63-4

Created by admin on Sat Dec 16 10:50:43 GMT 2023 , Edited by admin on Sat Dec 16 10:50:43 GMT 2023

PRIMARY

Related Record Type Details


					KRE4EAL66E

1-((1,1'-BIPHENYL)-4-YLHYDROXYAMINO)-1-DEOXY-.BETA.-D-GLUCOPYRANURONIC ACID

PARENT -> SALT/SOLVATE