| 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
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
| Molecular Formula | Ca |
| Molecular Weight | 40.078 |
| Charge | 2 |
| Count |
MOL RATIO
1 MOL RATIO (average) |
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C12H20BO12 |
| Molecular Weight | 367.091 |
| Charge | -1 |
| Count |
MOL RATIO
2 MOL RATIO (average) |
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 8 / 8 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |