Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C24H13N4O11S3.3Na |
| Molecular Weight | 698.545 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].[Na+].[O-][N+](=O)C1=CC=C(C=CC2=CC=C(C=C2S([O-])(=O)=O)N3N=C4C=C(C5=C(C=CC=C5)C4=N3)S([O-])(=O)=O)C(=C1)S([O-])(=O)=O
InChI
InChIKey=SMGMFTGDFISQCE-FWMLTEASSA-K
InChI=1S/C24H16N4O11S3.3Na/c29-28(30)17-10-8-15(22(12-17)41(34,35)36)6-5-14-7-9-16(11-21(14)40(31,32)33)27-25-20-13-23(42(37,38)39)18-3-1-2-4-19(18)24(20)26-27;;;/h1-13H,(H,31,32,33)(H,34,35,36)(H,37,38,39);;;/q;3*+1/p-3/b6-5+;;;
| 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 | C24H13N4O11S3 |
| Molecular Weight | 629.575 |
| Charge | -3 |
| 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
Wed Apr 02 17:17:16 GMT 2025
by
admin
on
Wed Apr 02 17:17:16 GMT 2025
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| Record UNII |
SAD3NFA7GH
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| Record Status |
Validated (UNII)
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| Record Version |
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172397
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SAD3NFA7GH
Created by
admin on Wed Apr 02 17:17:16 GMT 2025 , Edited by admin on Wed Apr 02 17:17:16 GMT 2025
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69178-37-6
Created by
admin on Wed Apr 02 17:17:16 GMT 2025 , Edited by admin on Wed Apr 02 17:17:16 GMT 2025
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DTXSID70890031
Created by
admin on Wed Apr 02 17:17:16 GMT 2025 , Edited by admin on Wed Apr 02 17:17:16 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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![Structure of 2-[4-[2-(4-Nitro-2-sulphophenyl)vinyl]-3-sulphophenyl]-2H-naphtho[1,2-d]triazole-5-sulphonic acid](/img/e221dc40-1320-4358-b469-9b56cbfdc7eb.svg "Structure of 2-[4-[2-(4-Nitro-2-sulphophenyl)vinyl]-3-sulphophenyl]-2H-naphtho[1,2-d]triazole-5-sulphonic acid")