Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C16H8N4O11S2.2Na |
| Molecular Weight | 542.364 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].OC1=C(\N=N\C2=CC=C(C=C2[N+]([O-])=O)[N+]([O-])=O)C(=CC3=CC(=CC=C13)S([O-])(=O)=O)S([O-])(=O)=O
InChI
InChIKey=XBLIFEQTVVSTIM-QIKYXUGXSA-L
InChI=1S/C16H10N4O11S2.2Na/c21-16-11-3-2-10(32(26,27)28)5-8(11)6-14(33(29,30)31)15(16)18-17-12-4-1-9(19(22)23)7-13(12)20(24)25;;/h1-7,21H,(H,26,27,28)(H,29,30,31);;/q;2*+1/p-2/b18-17+;;
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C461
Created by
admin on Fri Dec 15 15:43:01 GMT 2023 , Edited by admin on Fri Dec 15 15:43:01 GMT 2023
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5423-07-4
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C66368
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C013617
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9360
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DTXSID0063866
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226-549-8
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4U1WVN6KUX
Created by
admin on Fri Dec 15 15:43:01 GMT 2023 , Edited by admin on Fri Dec 15 15:43:01 GMT 2023
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CHEMBL2110712
Created by
admin on Fri Dec 15 15:43:01 GMT 2023 , Edited by admin on Fri Dec 15 15:43:01 GMT 2023
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PRIMARY |
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
