U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula CO3.2Al.4Mg.12HO.3H2O
Molecular Weight 469.3259
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VANGATALCITE

SMILES

O.O.O.[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Mg++].[Mg++].[Mg++].[Mg++].[Al+3].[Al+3].[O-]C([O-])=O

InChI

InChIKey=HITXWGXAPHJXHJ-UHFFFAOYSA-A
InChI=1S/CH2O3.2Al.4Mg.15H2O/c2-1(3)4;;;;;;;;;;;;;;;;;;;;;/h(H2,2,3,4);;;;;;;15*1H2/q;2*+3;4*+2;;;;;;;;;;;;;;;/p-14

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 Mg
Molecular Weight 24.305
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula CH2O3
Molecular Weight 62.0248
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Al
Molecular Weight 26.9815
Charge 3
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 10:05:22 UTC 2023
Edited
by admin
on Sat Dec 16 10:05:22 UTC 2023
Record UNII
5VFH8TY779
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VANGATALCITE
INN  
INN  
Official Name English
ALUMINUM MAGNESIUM CARBONATE HYDROXIDE (AL2MG4(CO3)(OH)12) TRIHYDRATE
Systematic Name English
ALUMINATE (AL(OH)63-), (OC-6-11)-, MAGNESIUM CARBONATE (2:4:1), TRIHYDRATE
Systematic Name English
ALUMINATE (AL(OH)63-), (OC-6-11)-, MAGNESIUM CARBONATE, HYDRATE (2:4:1:3)
Systematic Name English
DIALUMINUM TETRAMAGNESIUM CARBONATE DODECAHYDROXIDE TRIHYDRATE
Common Name English
MA-20
Code English
vangatalcite [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29633
Created by admin on Sat Dec 16 10:05:22 UTC 2023 , Edited by admin on Sat Dec 16 10:05:22 UTC 2023
Code System Code Type Description
FDA UNII
5VFH8TY779
Created by admin on Sat Dec 16 10:05:22 UTC 2023 , Edited by admin on Sat Dec 16 10:05:22 UTC 2023
PRIMARY
ChEMBL
CHEMBL2108826
Created by admin on Sat Dec 16 10:05:22 UTC 2023 , Edited by admin on Sat Dec 16 10:05:22 UTC 2023
PRIMARY
PUBCHEM
76955826
Created by admin on Sat Dec 16 10:05:22 UTC 2023 , Edited by admin on Sat Dec 16 10:05:22 UTC 2023
PRIMARY
CAS
12539-23-0
Created by admin on Sat Dec 16 10:05:22 UTC 2023 , Edited by admin on Sat Dec 16 10:05:22 UTC 2023
PRIMARY
INN
7810
Created by admin on Sat Dec 16 10:05:22 UTC 2023 , Edited by admin on Sat Dec 16 10:05:22 UTC 2023
PRIMARY
SMS_ID
300000034414
Created by admin on Sat Dec 16 10:05:22 UTC 2023 , Edited by admin on Sat Dec 16 10:05:22 UTC 2023
PRIMARY
NCI_THESAURUS
C152827
Created by admin on Sat Dec 16 10:05:22 UTC 2023 , Edited by admin on Sat Dec 16 10:05:22 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY