Drug Information
| Drug General Information | |||||
|---|---|---|---|---|---|
| Drug ID |
D0L8BN
|
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| Former ID |
DNC008559
|
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| Drug Name |
TOPOSTATIN
|
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| Drug Type |
Small molecular drug
|
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| Indication | Discovery agent | Investigative | [526096] | ||
| Structure |
|
Download2D MOL |
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| Formula |
C36H58N4O11S
|
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| Canonical SMILES |
CCCCCCCC(C)CC=C(C)C=CC(=O)C(C)CCC1C(C(=O)NC(=C)C(=O)NCC<br />(C(=O)NC(C(=O)O1)CC(C(=O)N)OS(=O)(=O)O)C)C
|
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| InChI |
1S/C36H58N4O11S/c1-8-9-10-11-12-13-22(2)14-15-23(3)16-18-29(41)24(4)17-19-30-26(6)34(44)39-27(7)35(45)38-21-25(5)33(43)40-28(36(46)50-30)20-31(32(37)42)51-52(47,48)49/h15-16,18,22,24-26,28,30-31H,7-14,17,19-21H2,1-6H3,(H2,37,42)(H,38,45)(H,39,44)(H,40,43)(H,47,48,49)/b18-16+,23-15+/t22?,24?,25-,26?,28-,30?,31?/m0/s1
|
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| InChIKey |
XLDIAUNLPWGNHO-NUPNHORYSA-N
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| PubChem Compound ID | |||||
| Target and Pathway | |||||
| Target(s) | DNA topoisomerase II | Target Info | Inhibitor | [526096] | |
| DNA topoisomerase I | Target Info | Inhibitor | [526096] | ||
| DNA topoisomerase | Target Info | Inhibitor | [526096] | ||
| WikiPathways | Integrated Pancreatic Cancer Pathway | ||||
| References | |||||
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