Details
Stereochemistry | ACHIRAL |
Molecular Formula | C25H26N9O12S3.3Na |
Molecular Weight | 809.691 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].[Na+].NC1=C(\N=N\C2=CC=C(NC3=NC(=NC(NCCS([O-])(=O)=O)=N3)N(CCO)CCO)C=C2S([O-])(=O)=O)C4=C(O)C=C(C=C4C=C1)S([O-])(=O)=O
InChI
InChIKey=VWNSBGOBYYGHQL-KGMXHPFTSA-K
InChI=1S/C25H29N9O12S3.3Na/c26-17-3-1-14-11-16(48(41,42)43)13-19(37)21(14)22(17)33-32-18-4-2-15(12-20(18)49(44,45)46)28-24-29-23(27-5-10-47(38,39)40)30-25(31-24)34(6-8-35)7-9-36;;;/h1-4,11-13,35-37H,5-10,26H2,(H,38,39,40)(H,41,42,43)(H,44,45,46)(H2,27,28,29,30,31);;;/q;3*+1/p-3/b33-32+;;;
Approval Year
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DTXSID30890476
Created by
admin on Sat Dec 16 20:02:07 GMT 2023 , Edited by admin on Sat Dec 16 20:02:07 GMT 2023
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7WG9SCR4QH
Created by
admin on Sat Dec 16 20:02:07 GMT 2023 , Edited by admin on Sat Dec 16 20:02:07 GMT 2023
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136274452
Created by
admin on Sat Dec 16 20:02:07 GMT 2023 , Edited by admin on Sat Dec 16 20:02:07 GMT 2023
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182061-89-8
Created by
admin on Sat Dec 16 20:02:07 GMT 2023 , Edited by admin on Sat Dec 16 20:02:07 GMT 2023
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PRIMARY |
SUBSTANCE RECORD