Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C41H52N4O4S.CH4O3S |
| Molecular Weight | 793.047 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(O)(=O)=O.CCCCOCCOC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CC(C)C)CCCC(=C3)C(=O)NC4=CC=C(C=C4)[S@@+]([O-])CC5=CN=CN5CCC
InChI
InChIKey=IXPBPUPDRDCRSY-YLZLUMLXSA-N
InChI=1S/C41H52N4O4S.CH4O3S/c1-5-7-22-48-23-24-49-38-15-10-32(11-16-38)33-12-19-40-35(25-33)26-34(9-8-21-44(40)28-31(3)4)41(46)43-36-13-17-39(18-14-36)50(47)29-37-27-42-30-45(37)20-6-2;1-5(2,3)4/h10-19,25-27,30-31H,5-9,20-24,28-29H2,1-4H3,(H,43,46);1H3,(H,2,3,4)/b34-26+;/t50-;/m0./s1
Approval Year
| Name | Type | Language | ||
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| Code System | Code | Type | Description | ||
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SUB180705
Created by
admin on Fri Dec 15 18:18:28 UTC 2023 , Edited by admin on Fri Dec 15 18:18:28 UTC 2023
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100000166551
Created by
admin on Fri Dec 15 18:18:28 UTC 2023 , Edited by admin on Fri Dec 15 18:18:28 UTC 2023
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CHEMBL2110727
Created by
admin on Fri Dec 15 18:18:28 UTC 2023 , Edited by admin on Fri Dec 15 18:18:28 UTC 2023
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C169838
Created by
admin on Fri Dec 15 18:18:28 UTC 2023 , Edited by admin on Fri Dec 15 18:18:28 UTC 2023
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R96TV84T21
Created by
admin on Fri Dec 15 18:18:28 UTC 2023 , Edited by admin on Fri Dec 15 18:18:28 UTC 2023
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149636
Created by
admin on Fri Dec 15 18:18:28 UTC 2023 , Edited by admin on Fri Dec 15 18:18:28 UTC 2023
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497223-28-6
Created by
admin on Fri Dec 15 18:18:28 UTC 2023 , Edited by admin on Fri Dec 15 18:18:28 UTC 2023
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DBSALT002066
Created by
admin on Fri Dec 15 18:18:28 UTC 2023 , Edited by admin on Fri Dec 15 18:18:28 UTC 2023
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11285791
Created by
admin on Fri Dec 15 18:18:28 UTC 2023 , Edited by admin on Fri Dec 15 18:18:28 UTC 2023
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WW-90
Created by
admin on Fri Dec 15 18:18:28 UTC 2023 , Edited by admin on Fri Dec 15 18:18:28 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD