Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C32H26N12O6S2.2Na |
| Molecular Weight | 784.735 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].NC1=NC(NC2=CC=CC=C2)=NC(NC3=CC=C(\C=C/C4=CC=C(NC5=NC(N)=NC(NC6=CC=CC=C6)=N5)C=C4S([O-])(=O)=O)C(=C3)S([O-])(=O)=O)=N1
InChI
InChIKey=XTYKHCPNKDNILW-IPEZHVIRSA-L
InChI=1S/C32H28N12O6S2.2Na/c33-27-39-29(35-21-7-3-1-4-8-21)43-31(41-27)37-23-15-13-19(25(17-23)51(45,46)47)11-12-20-14-16-24(18-26(20)52(48,49)50)38-32-42-28(34)40-30(44-32)36-22-9-5-2-6-10-22;;/h1-18H,(H,45,46,47)(H,48,49,50)(H4,33,35,37,39,41,43)(H4,34,36,38,40,42,44);;/q;2*+1/p-2/b12-11-;;
Approval Year
| Name | Type | Language | ||
|---|---|---|---|---|
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Preferred Name | English | ||
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Common Name | English | ||
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Systematic Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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510DL4UP4V
Created by
admin on Mon Mar 31 23:40:39 GMT 2025 , Edited by admin on Mon Mar 31 23:40:39 GMT 2025
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PRIMARY | |||
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92629-70-4
Created by
admin on Mon Mar 31 23:40:39 GMT 2025 , Edited by admin on Mon Mar 31 23:40:39 GMT 2025
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PRIMARY | |||
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112500464
Created by
admin on Mon Mar 31 23:40:39 GMT 2025 , Edited by admin on Mon Mar 31 23:40:39 GMT 2025
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PRIMARY |
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
