Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C47H34N14O6S.2Na |
| Molecular Weight | 968.908 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 5 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].NC1=CC=C(\N=N\C2=CC(=CC=C2)\N=N\C3=C(N)C(N)=CC=C3\N=N\C4=C5C=CC=CC5=C(\N=N\C6=CC=C(C=C6)C7=CC=C(C=C7)\N=N\C8=CC=C(O)C(=C8)C([O-])=O)C(=C4)S([O-])(=O)=O)C(N)=C1
InChI
InChIKey=LYLOTUQQMDFHHJ-JBBGMNHDSA-L
InChI=1S/C47H36N14O6S.2Na/c48-28-12-19-39(38(50)22-28)57-55-31-4-3-5-32(23-31)56-61-46-40(20-18-37(49)44(46)51)58-59-41-25-43(68(65,66)67)45(35-7-2-1-6-34(35)41)60-53-30-15-10-27(11-16-30)26-8-13-29(14-9-26)52-54-33-17-21-42(62)36(24-33)47(63)64;;/h1-25,62H,48-51H2,(H,63,64)(H,65,66,67);;/q;2*+1/p-2/b54-52+,57-55+,59-58+,60-53+,61-56+;;
| Molecular Formula | Na |
| Molecular Weight | 22.98976928 |
| Charge | 1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C47H34N14O6S |
| Molecular Weight | 922.928 |
| Charge | -2 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 5 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 23:36:24 GMT 2025
by
admin
on
Mon Mar 31 23:36:24 GMT 2025
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| Record UNII |
77QS9AIW2V
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| Record Status |
Validated (UNII)
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| Record Version |
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