Drug Information
| Drug General Information | |||||
|---|---|---|---|---|---|
| Drug ID |
D0J5RQ
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| Former ID |
DNC010346
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| Drug Name |
3-acetyl-11-keto-ursolic acid
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent | Investigative | [530656] | ||
| Structure |
|
Download2D MOL |
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| Formula |
C32H48O5
|
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| Canonical SMILES |
CC1CCC2(CCC3(C(=CC(=O)C4C3(CCC5C4(CCC(C5(C)C)OC(=O)C)C)<br />C)C2C1C)C)C(=O)O
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| InChI |
1S/C32H48O5/c1-18-9-14-32(27(35)36)16-15-30(7)21(25(32)19(18)2)17-22(34)26-29(6)12-11-24(37-20(3)33)28(4,5)23(29)10-13-31(26,30)8/h17-19,23-26H,9-16H2,1-8H3,(H,35,36)/t18-,19+,23+,24+,25+,26-,29+,30-,31-,32+/m1/s1
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| InChIKey |
XDHCWTUZCOFKRH-CIKBGXLUSA-N
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| PubChem Compound ID | |||||
| Target and Pathway | |||||
| Target(s) | Corticosteroid 11-beta-dehydrogenase, isozyme 1 | Target Info | Inhibitor | [530656] | |
| NetPath Pathway | IL1 Signaling Pathway | ||||
| FSH Signaling Pathway | |||||
| PathWhiz Pathway | Steroidogenesis | ||||
| Reactome | Glucocorticoid biosynthesis | ||||
| References | |||||
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