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

Details

Stereochemistry ABSOLUTE
Molecular Formula 2C12H20BO12.Ca
Molecular Weight 774.26
Optical Activity UNSPECIFIED
Defined Stereocenters 16 / 16
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CALCIUM FRUCTOBORATE

SMILES

[Ca++].[H][C@@]12O[B-]3(O[C@@]4([H])[C@H](O)[C@@H](CO)O[C@@]4(CO)O3)O[C@]1(CO)O[C@H](CO)[C@H]2O.[H][C@@]56O[B-]7(O[C@@]8([H])[C@H](O)[C@@H](CO)O[C@@]8(CO)O7)O[C@]5(CO)O[C@H](CO)[C@H]6O

InChI

InChIKey=HRSMKOBEJUELDV-XBNRZDKMSA-N
InChI=1S/2C12H20BO12.Ca/c2*14-1-5-7(18)9-11(3-16,20-5)24-13(22-9)23-10-8(19)6(2-15)21-12(10,4-17)25-13;/h2*5-10,14-19H,1-4H2;/q2*-1;+2/t2*5-,6-,7-,8-,9+,10+,11+,12+,13?;/m11./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
CALCIUM FRUCTOBORATE
INCI  
Official Name English
Calcium fructoborate [WHO-DD]
Common Name English
BORATE(1-), BIS(.BETA.-D-FRUCTOFURANOSATO(2-)-.KAPPA.O2,.KAPPA.O3)-, CALCIUM (2:1), (T-4)-
Systematic Name English
Code System Code Type Description
CAS
250141-42-5
Created by admin on Sat Dec 16 16:30:14 GMT 2023 , Edited by admin on Sat Dec 16 16:30:14 GMT 2023
PRIMARY
RXCUI
2600351
Created by admin on Sat Dec 16 16:30:14 GMT 2023 , Edited by admin on Sat Dec 16 16:30:14 GMT 2023
PRIMARY
EPA CompTox
DTXSID701045983
Created by admin on Sat Dec 16 16:30:14 GMT 2023 , Edited by admin on Sat Dec 16 16:30:14 GMT 2023
PRIMARY
PUBCHEM
9962298
Created by admin on Sat Dec 16 16:30:14 GMT 2023 , Edited by admin on Sat Dec 16 16:30:14 GMT 2023
PRIMARY
WIKIPEDIA
Calcium fructoborate
Created by admin on Sat Dec 16 16:30:14 GMT 2023 , Edited by admin on Sat Dec 16 16:30:14 GMT 2023
PRIMARY
DAILYMED
7EW2EZ38LS
Created by admin on Sat Dec 16 16:30:14 GMT 2023 , Edited by admin on Sat Dec 16 16:30:14 GMT 2023
PRIMARY
FDA UNII
7EW2EZ38LS
Created by admin on Sat Dec 16 16:30:14 GMT 2023 , Edited by admin on Sat Dec 16 16:30:14 GMT 2023
PRIMARY