Details
| Stereochemistry | MIXED |
| Molecular Formula | C17H16N2O6S.2Na |
| Molecular Weight | 422.363 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)C(C([O-])=O)C3=CC=CC=C3)C([O-])=O
InChI
InChIKey=RTYJTGSCYUUYAL-YCAHSCEMSA-L
InChI=1S/C17H18N2O6S.2Na/c1-17(2)11(16(24)25)19-13(21)10(14(19)26-17)18-12(20)9(15(22)23)8-6-4-3-5-7-8;;/h3-7,9-11,14H,1-2H3,(H,18,20)(H,22,23)(H,24,25);;/q;2*+1/p-2/t9?,10-,11+,14-;;/m1../s1
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C1558
Created by
admin on Fri Dec 15 15:24:04 UTC 2023 , Edited by admin on Fri Dec 15 15:24:04 UTC 2023
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| Code System | Code | Type | Description | ||
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C65285
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4800-94-6
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DBSALT001334
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9TS4B3H261
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111071
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100000076395
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m3063
Created by
admin on Fri Dec 15 15:24:04 UTC 2023 , Edited by admin on Fri Dec 15 15:24:04 UTC 2023
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PRIMARY | Merck Index | ||
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20933
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admin on Fri Dec 15 15:24:04 UTC 2023 , Edited by admin on Fri Dec 15 15:24:04 UTC 2023
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DTXSID6045820
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258332
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34609
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CHEMBL1214
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SUB11789MIG
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225-360-8
Created by
admin on Fri Dec 15 15:24:04 UTC 2023 , Edited by admin on Fri Dec 15 15:24:04 UTC 2023
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ACTIVE MOIETY
SUBSTANCE RECORD