Details
Stereochemistry | ACHIRAL |
Molecular Formula | C50H27N8O17S5.5Na |
Molecular Weight | 1287.067 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 4 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].[Na+].[Na+].[Na+].OC1=C(\N=N\C2=CC=C3C=C(C(\N=N\C4=CC=C(\N=N\C5=CC=C(\N=N\C6=CC7=C(C=CC=C7C(=C6)S([O-])(=O)=O)S([O-])(=O)=O)C8=CC=CC=C58)C9=CC=C(C=C49)S([O-])(=O)=O)=C(O)C3=C2)S([O-])(=O)=O)C%10=CC=C(C=C%10C=C1)S([O-])(=O)=O
InChI
InChIKey=FLOUWGDMSMWHTL-MAZDEWDRSA-I
InChI=1S/C50H32N8O17S5.5Na/c59-44-19-9-26-20-30(76(61,62)63)11-13-32(26)48(44)57-51-28-10-8-27-21-47(80(73,74)75)49(50(60)37(27)22-28)58-56-43-18-17-42(35-14-12-31(25-38(35)43)77(64,65)66)55-54-41-16-15-40(33-4-1-2-5-34(33)41)53-52-29-23-39-36(46(24-29)79(70,71)72)6-3-7-45(39)78(67,68)69;;;;;/h1-25,59-60H,(H,61,62,63)(H,64,65,66)(H,67,68,69)(H,70,71,72)(H,73,74,75);;;;;/q;5*+1/p-5/b53-52+,55-54+,57-51+,58-56+;;;;;
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 | C50H27N8O17S5 |
Molecular Weight | 1172.118 |
Charge | -5 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 4 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 11:03:35 GMT 2023
by
admin
on
Sat Dec 16 11:03:35 GMT 2023
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Record UNII |
B9I2DO4X39
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Record Status |
Validated (UNII)
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Record Version |
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-
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Created by
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2679-49-4
Created by
admin on Sat Dec 16 11:03:35 GMT 2023 , Edited by admin on Sat Dec 16 11:03:35 GMT 2023
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NON-SPECIFIC STEREOCHEMISTRY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |