Drug Information
| Drug General Information | Top | |||
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| Drug ID |
D06ZIE
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| Former ID |
DNC005377
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| Drug Name |
SCANDENOLIDE
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| Synonyms |
Scandenolide; 23758-16-9; AC1Q62GG; AC1L40IU; NSC145911; NSC-145911; 10a-methyl-3-methylidene-2,6-dioxodecahydro-4,7-(metheno)furo[3,2-c]oxireno[f]oxacycloundecin-8(6h)-yl acetate; 5H-7,4-Methenofuro(3,2-c)oxireno(f)oxacycloundecin-5,9(7H)-dione, 3-(acetyloxy)-1a,2,3,7a,8,10a,11,11a-octahydro-11a-methyl-8-methylene-, (1aS-(1aR*,3R*,7S*,7aS*,10aR*,11aR*))-
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
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Download2D MOL |
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| Formula |
C17H18O7
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| Canonical SMILES |
CC(=O)OC1CC2C(O2)(CC3C(C4C=C1C(=O)O4)C(=C)C(=O)O3)C
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| InChI |
1S/C17H18O7/c1-7-14-11-4-9(16(20)22-11)10(21-8(2)18)5-13-17(3,24-13)6-12(14)23-15(7)19/h4,10-14H,1,5-6H2,2-3H3
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| InChIKey |
SLIMCFUYVZKJTC-UHFFFAOYSA-N
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| CAS Number |
CAS 23758-16-9
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| PubChem Compound ID | ||||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | Quantitative structure-activity relationship of sesquiterpene lactones as inhibitors of the transcription factor NF-kappaB. J Med Chem. 2004 Nov 18;47(24):6042-54. | |||
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