Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C12H14N5O6S.Na |
| Molecular Weight | 379.324 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].CO\N=C(/C(=O)N[C@H]1[C@H](C)N(OCC([O-])=O)C1=O)C2=CSC(N)=N2
InChI
InChIKey=IEJDXDFBVQORAZ-CTRAYMKSSA-M
InChI=1S/C12H15N5O6S.Na/c1-5-8(11(21)17(5)23-3-7(18)19)15-10(20)9(16-22-2)6-4-24-12(13)14-6;/h4-5,8H,3H2,1-2H3,(H2,13,14)(H,15,20)(H,18,19);/q;+1/p-1/b16-9-;/t5-,8-;/m0./s1
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C260
Created by
admin on Fri Dec 15 15:40:55 UTC 2023 , Edited by admin on Fri Dec 15 15:40:55 UTC 2023
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C66267
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90849-08-4
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23663948
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admin on Fri Dec 15 15:40:55 UTC 2023 , Edited by admin on Fri Dec 15 15:40:55 UTC 2023
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CHEMBL2104567
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G274R51QFV
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admin on Fri Dec 15 15:40:55 UTC 2023 , Edited by admin on Fri Dec 15 15:40:55 UTC 2023
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X-6
Created by
admin on Fri Dec 15 15:40:55 UTC 2023 , Edited by admin on Fri Dec 15 15:40:55 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD