Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C25H32O8.C21H26ClN3OS |
| Molecular Weight | 864.485 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 7 / 7 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OCCN1CCN(CCCN2C3=CC=CC=C3SC4=C2C=C(Cl)C=C4)CC1.[H][C@@]56CC[C@](O)(C(=O)COC(=O)CCC(O)=O)[C@@]5(C)C[C@H](O)[C@@]7([H])[C@@]6([H])CCC8=CC(=O)C=C[C@]78C
InChI
InChIKey=QKKLKGVIECOSRM-CODXZCKSSA-N
InChI=1S/C25H32O8.C21H26ClN3OS/c1-23-9-7-15(26)11-14(23)3-4-16-17-8-10-25(32,24(17,2)12-18(27)22(16)23)19(28)13-33-21(31)6-5-20(29)30;22-17-6-7-21-19(16-17)25(18-4-1-2-5-20(18)27-21)9-3-8-23-10-12-24(13-11-23)14-15-26/h7,9,11,16-18,22,27,32H,3-6,8,10,12-13H2,1-2H3,(H,29,30);1-2,4-7,16,26H,3,8-15H2/t16-,17-,18-,22+,23-,24-,25-;/m0./s1
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C2356
Created by
admin on Fri Dec 15 16:15:05 UTC 2023 , Edited by admin on Fri Dec 15 16:15:05 UTC 2023
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| Code System | Code | Type | Description | ||
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SUB10013MIG
Created by
admin on Fri Dec 15 16:15:05 UTC 2023 , Edited by admin on Fri Dec 15 16:15:05 UTC 2023
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PRIMARY | |||
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DTXSID70972604
Created by
admin on Fri Dec 15 16:15:05 UTC 2023 , Edited by admin on Fri Dec 15 16:15:05 UTC 2023
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5714-75-0
Created by
admin on Fri Dec 15 16:15:05 UTC 2023 , Edited by admin on Fri Dec 15 16:15:05 UTC 2023
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Prednazate
Created by
admin on Fri Dec 15 16:15:05 UTC 2023 , Edited by admin on Fri Dec 15 16:15:05 UTC 2023
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1944
Created by
admin on Fri Dec 15 16:15:05 UTC 2023 , Edited by admin on Fri Dec 15 16:15:05 UTC 2023
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PRIMARY | |||
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100000081403
Created by
admin on Fri Dec 15 16:15:05 UTC 2023 , Edited by admin on Fri Dec 15 16:15:05 UTC 2023
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10010848
Created by
admin on Fri Dec 15 16:15:05 UTC 2023 , Edited by admin on Fri Dec 15 16:15:05 UTC 2023
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PRIMARY | |||
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C82228
Created by
admin on Fri Dec 15 16:15:05 UTC 2023 , Edited by admin on Fri Dec 15 16:15:05 UTC 2023
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71099P640P
Created by
admin on Fri Dec 15 16:15:05 UTC 2023 , Edited by admin on Fri Dec 15 16:15:05 UTC 2023
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PRIMARY |
ACTIVE MOIETY
ACTIVE MOIETY
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD