CALCIUM 5'-GUANYLATE HEXAHYDRATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C10H12N5O8P.Ca.6H2O
Molecular Weight	509.374
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of CALCIUM 5'-GUANYLATE HEXAHYDRATE

Structure Search

SMILES

O.O.O.O.O.O.[Ca++].NC1=NC2=C(N=CN2[C@@H]3O[C@H](COP([O-])([O-])=O)[C@@H](O)[C@H]3O)C(=O)N1

InChI

InChIKey=PGDSCLQZCVHPJL-OMFUSAEPSA-L

InChI=1S/C10H14N5O8P.Ca.6H2O/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(23-9)1-22-24(19,20)21;;;;;;;/h2-3,5-6,9,16-17H,1H2,(H2,19,20,21)(H3,11,13,14,18);;6*1H2/q;+2;;;;;;/p-2/t3-,5-,6-,9-;;;;;;;/m1......./s1

HIDE SMILES / InChI

Molecular Formula	C10H12N5O8P
Molecular Weight	361.2047
Charge	-2
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

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	Ca
Molecular Weight	40.078
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 `Sat Dec 16 10:08:24 GMT 2023` Edited by `admin` on `Sat Dec 16 10:08:24 GMT 2023`
Record UNII	03LAZ1TDFJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CALCIUM 5'-GUANYLATE HEXAHYDRATE

Common Name

English

5'-GUANYLIC ACID, CALCIUM SALT (1:1), HEXAHYDRATE

Common Name

English

Code System Code Type Description

FDA UNII

03LAZ1TDFJ

Created by admin on Sat Dec 16 10:08:24 GMT 2023 , Edited by admin on Sat Dec 16 10:08:24 GMT 2023

PRIMARY

CAS

134207-13-9

Created by admin on Sat Dec 16 10:08:24 GMT 2023 , Edited by admin on Sat Dec 16 10:08:24 GMT 2023

PRIMARY

PUBCHEM

135565157

Created by admin on Sat Dec 16 10:08:24 GMT 2023 , Edited by admin on Sat Dec 16 10:08:24 GMT 2023

PRIMARY

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