| Stereochemistry | ABSOLUTE |
| Molecular Formula | 2C32H30F9N4O5.Ca |
| Molecular Weight | 1483.258 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].CCOC(=O)N1[C@H](CC)C[C@H](N(CC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=NC=C(OCCCC([O-])=O)C=N3)C4=CC(=CC=C14)C(F)(F)F.CCOC(=O)N5[C@H](CC)C[C@H](N(CC6=CC(=CC(=C6)C(F)(F)F)C(F)(F)F)C7=NC=C(OCCCC([O-])=O)C=N7)C8=CC(=CC=C58)C(F)(F)F
InChI
InChIKey=QJYLTBPMVPTRPX-NVRNJZRHSA-L
InChI=1S/2C32H31F9N4O5.Ca/c2*1-3-22-14-26(24-13-19(30(33,34)35)7-8-25(24)45(22)29(48)49-4-2)44(28-42-15-23(16-43-28)50-9-5-6-27(46)47)17-18-10-20(31(36,37)38)12-21(11-18)32(39,40)41;/h2*7-8,10-13,15-16,22,26H,3-6,9,14,17H2,1-2H3,(H,46,47);/q;;+2/p-2/t2*22-,26+;/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 | C32H30F9N4O5 |
| Molecular Weight | 721.59 |
| Charge | -1 |
| Count |
MOL RATIO
2 MOL RATIO (average) |
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
