Details
Stereochemistry | ACHIRAL |
Molecular Formula | C16H11N3O7S2.2Na |
Molecular Weight | 467.384 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].NC1=CC(=CC2=CC(=C(\N=N\C3=CC=CC=C3)C(O)=C12)S([O-])(=O)=O)S([O-])(=O)=O
InChI
InChIKey=LQJVOKWHGUAUHK-BUFQOAPZSA-L
InChI=1S/C16H13N3O7S2.2Na/c17-12-8-11(27(21,22)23)6-9-7-13(28(24,25)26)15(16(20)14(9)12)19-18-10-4-2-1-3-5-10;;/h1-8,20H,17H2,(H,21,22,23)(H,24,25,26);;/q;2*+1/p-2/b19-18+;;
Molecular Formula | Na |
Molecular Weight | 22.9898 |
Charge | 1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C16H11N3O7S2 |
Molecular Weight | 421.404 |
Charge | -2 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:26:19 GMT 2023
by
admin
on
Fri Dec 15 16:26:19 GMT 2023
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Record UNII |
9DBA0SBB0L
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Record Status |
Validated (UNII)
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Record Version |
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C461
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admin on Fri Dec 15 16:26:19 GMT 2023 , Edited by admin on Fri Dec 15 16:26:19 GMT 2023
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C71663
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5004
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3567-66-6
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9DBA0SBB0L
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DTXSID1044562
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9DBA0SBB0L
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222-656-9
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12190
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C044608
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1310601
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |