| Stereochemistry | ACHIRAL |
| Molecular Formula | C39H21ClN9O17S5.5Na |
| Molecular Weight | 1198.361 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].[Na+].[Na+].[Na+].NC1=C(C=C(NC2=CC(NC3=NC(NC4=CC=C(C=C4)\N=N\C5=CC6=C(C=C(C=C6S([O-])(=O)=O)S([O-])(=O)=O)C(=C5)S([O-])(=O)=O)=NC(Cl)=N3)=C(C=C2)S([O-])(=O)=O)C7=C1C(=O)C8=CC=CC=C8C7=O)S([O-])(=O)=O
InChI
InChIKey=KFRWQMRFNAXWAV-MPVGBDGQSA-I
InChI=1S/C39H26ClN9O17S5.5Na/c40-37-45-38(43-17-5-7-18(8-6-17)48-49-20-11-24-25(29(13-20)69(58,59)60)14-21(67(52,53)54)15-30(24)70(61,62)63)47-39(46-37)44-26-12-19(9-10-28(26)68(55,56)57)42-27-16-31(71(64,65)66)34(41)33-32(27)35(50)22-3-1-2-4-23(22)36(33)51;;;;;/h1-16,42H,41H2,(H,52,53,54)(H,55,56,57)(H,58,59,60)(H,61,62,63)(H,64,65,66)(H2,43,44,45,46,47);;;;;/q;5*+1/p-5/b49-48+;;;;;
| Molecular Formula | Na |
| Molecular Weight | 22.98976928 |
| Charge | 1 |
| Count |
MOL RATIO
5 MOL RATIO (average) |
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C39H21ClN9O17S5 |
| Molecular Weight | 1083.412 |
| Charge | -5 |
| Count |
MOL RATIO
1 MOL RATIO (average) |
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Optical Activity | NONE |
Approval Year
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