Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C20H26N2O4.CH4O3S |
| Molecular Weight | 454.537 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(O)(=O)=O.O=C1CC2(CCCC2)CC(=O)N1CCNCC3COC4=CC=CC=C4O3
InChI
InChIKey=JXBLEDCYKVWLJI-UHFFFAOYSA-N
InChI=1S/C20H26N2O4.CH4O3S/c23-18-11-20(7-3-4-8-20)12-19(24)22(18)10-9-21-13-15-14-25-16-5-1-2-6-17(16)26-15;1-5(2,3)4/h1-2,5-6,15,21H,3-4,7-14H2;1H3,(H,2,3,4)
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C28197
Created by
admin on Fri Dec 15 16:20:04 UTC 2023 , Edited by admin on Fri Dec 15 16:20:04 UTC 2023
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| Code System | Code | Type | Description | ||
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155R3B9K8H
Created by
admin on Fri Dec 15 16:20:04 UTC 2023 , Edited by admin on Fri Dec 15 16:20:04 UTC 2023
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71346
Created by
admin on Fri Dec 15 16:20:04 UTC 2023 , Edited by admin on Fri Dec 15 16:20:04 UTC 2023
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C73223
Created by
admin on Fri Dec 15 16:20:04 UTC 2023 , Edited by admin on Fri Dec 15 16:20:04 UTC 2023
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124756-23-6
Created by
admin on Fri Dec 15 16:20:04 UTC 2023 , Edited by admin on Fri Dec 15 16:20:04 UTC 2023
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CHEMBL1487115
Created by
admin on Fri Dec 15 16:20:04 UTC 2023 , Edited by admin on Fri Dec 15 16:20:04 UTC 2023
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DTXSID6048676
Created by
admin on Fri Dec 15 16:20:04 UTC 2023 , Edited by admin on Fri Dec 15 16:20:04 UTC 2023
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CC-64
Created by
admin on Fri Dec 15 16:20:04 UTC 2023 , Edited by admin on Fri Dec 15 16:20:04 UTC 2023
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C063249
Created by
admin on Fri Dec 15 16:20:04 UTC 2023 , Edited by admin on Fri Dec 15 16:20:04 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD