.ALPHA.-GLUCOSE-1-PHOSPHATE BARIUM TRIHYDRATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C6H11O9P.Ba.3H2O
Molecular Weight	449.493
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of .ALPHA.-GLUCOSE-1-PHOSPHATE BARIUM TRIHYDRATE

Structure Search

SMILES

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

InChI

InChIKey=MDWOZJODNHJMNO-QMKHLHGBSA-L

InChI=1S/C6H13O9P.Ba.3H2O/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13;;;;/h2-10H,1H2,(H2,11,12,13);;3*1H2/q;+2;;;/p-2/t2-,3-,4+,5-,6-;;;;/m1..../s1

HIDE SMILES / InChI

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
Count

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

Molecular Formula	C6H11O9P
Molecular Weight	258.1199
Charge	-2
Count

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

Molecular Formula	Ba
Molecular Weight	137.327
Charge	2
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 `Mon Mar 31 22:28:39 GMT 2025` Edited by `admin` on `Mon Mar 31 22:28:39 GMT 2025`
Record UNII	C324J3XG8S
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

.ALPHA.-GLUCOSE-1-PHOSPHATE BARIUM TRIHYDRATE

Common Name

English

.ALPHA.-GLUCOSE-1-PHOSPHATE BARIUM TRIHYDRATE [MI]

Preferred Name

English

.ALPHA.-D-GLUCOPYRANOSE, 1-(DIHYDROGEN PHOSPHATE), BARIUM SALT (1:1), TRIHYDRATE

Systematic Name

English

.ALPHA.-GLUCOSE-1-PHOSPHATE, BARIUM SALT, TRIHYDRATE

Common Name

English

Code System Code Type Description

PUBCHEM

76971274

Created by admin on Mon Mar 31 22:28:39 GMT 2025 , Edited by admin on Mon Mar 31 22:28:39 GMT 2025

PRIMARY

FDA UNII

C324J3XG8S

Created by admin on Mon Mar 31 22:28:39 GMT 2025 , Edited by admin on Mon Mar 31 22:28:39 GMT 2025

PRIMARY

CAS

6056-70-8

Created by admin on Mon Mar 31 22:28:39 GMT 2025 , Edited by admin on Mon Mar 31 22:28:39 GMT 2025

PRIMARY

Related Record Type Details


					CIX3U01VAU

.ALPHA.-GLUCOSE-1-PHOSPHATE

PARENT -> SALT/SOLVATE


					706O8OR5TM

.ALPHA.-GLUCOSE-1-PHOSPHATE BARIUM

ANHYDROUS->SOLVATE