Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C16H20N2.2C8H11NO5S |
| Molecular Weight | 706.827 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]12CC(=O)N1[C@@H](C(O)=O)C(C)(C)S2(=O)=O.[H][C@@]34CC(=O)N3[C@@H](C(O)=O)C(C)(C)S4(=O)=O.C(CNCC5=CC=CC=C5)NCC6=CC=CC=C6
InChI
InChIKey=YSEPFTSCLHUBNH-HFKSPEPWSA-N
InChI=1S/C16H20N2.2C8H11NO5S/c1-3-7-15(8-4-1)13-17-11-12-18-14-16-9-5-2-6-10-16;2*1-8(2)6(7(11)12)9-4(10)3-5(9)15(8,13)14/h1-10,17-18H,11-14H2;2*5-6H,3H2,1-2H3,(H,11,12)/t;2*5-,6+/m.11/s1
Approval Year
| Name | Type | Language | ||
|---|---|---|---|---|
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Official Name | English | ||
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Common Name | English | ||
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Code | English | ||
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Systematic Name | English | ||
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Code | English |
| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
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NCI_THESAURUS |
C471
Created by
admin on Fri Dec 15 16:22:28 UTC 2023 , Edited by admin on Fri Dec 15 16:22:28 UTC 2023
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| Code System | Code | Type | Description | ||
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11954361
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DBSALT002843
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83031-43-0
Created by
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49MU89FVBV
Created by
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CHEMBL403
Created by
admin on Fri Dec 15 16:22:28 UTC 2023 , Edited by admin on Fri Dec 15 16:22:28 UTC 2023
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C90848
Created by
admin on Fri Dec 15 16:22:28 UTC 2023 , Edited by admin on Fri Dec 15 16:22:28 UTC 2023
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DTXSID701003088
Created by
admin on Fri Dec 15 16:22:28 UTC 2023 , Edited by admin on Fri Dec 15 16:22:28 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD
