Inhibitor Report for: Kurarinone
Kurarinone | Type | Natural |
| | Flavonoid |
| Other_Name (9) |
| Chemical_Nomenclature | (2S)-2-(2,4-dihydroxyphenyl)-7-hydroxy-5-methoxy-8-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)-2,3-dihydrochromen-4-one |
| Formula | C26H30O6 |
| CAS_number | 34981-26-5 |
| MW | 438.5 |
| |
| Paper | Song_2019_Int.J.Biol.Macromol_131_201 |
| | Kumar_2021_Front.Pharmacol_12_737137 |
| | Sun_2022_Proc.Natl.Acad.Sci.U.S.A_119_ |
| Structure | 7EBA |
| Comment | Kurarinone is a natural product found in Sophora flavescens, Sophora alopecuroides, Albizia julibrissin. Inhibits human-CES2 IC50 1.46+/-0.43, Ki 1.73 muM |
| Gene_locus | human-CES2 |
| CID | 10812923 |
| | 11982640 |
| | 5318882 |
| Family | Carb_B_Chordata |
| InChIKey | LTTQKYMNTNISSZ-KESSSICBSA-N |
| CanonicalSMILES | CC(=CCC(CC1=C2C(=C(C=C1O)OC)C(=O)CC(O2)C3=C(C=C(C=C3)O)O)C(=C)C)C |
| InChI | InChI=1S/C26H30O6/c1-14(2)6-7-16(15(3)4)10-19-21(29)12-24(31-5)25-22(30)13-23(32-26(19)25)18-9-8-17(27)11-20(18)28/h6,8-9,11-12,16,23,27-29H,3,7,10,13H2,1-2,4-5H3/t16?,23-/m0/s1 |
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