(-)-Phaseollin

Properties Image MNX_ID MNXM13454 reference keggC:C10514 formula C20H18O4 global charge 0 mol weight 322.36 InChIKey LWTDZKXXJRRKDG-KXBFYZLASA-N InChI InChI=1S/C20H18O4/c1-20(2)8-7-14-16(24-20)6-5-12-15-10-22-17-9-11(21)3-4-13(17)19(15)23-18(12)14/h3-9,15,19,21H,10H2,1-2H3/t15-,19-/m0/s1 SMILES CC1(C)C=CC2=C(C=CC3=C2O[C@H]2C4=C(C=C(O)C=C4)OC[C@@H]32)O1 MNX internals InChI (mnx) InChI=1/C20H18O4/c1-20(2)8-7-14-16(24-20)6-5-12-15-10-22-17-9-11(21)3-4-13(17)19(15)23-18(12)14/h3-9,15,19,21H,10H2,1-2H3/t15-,19-/m0/s1 SMILES (mnx) [CH3:1][C:20]1([CH3:2])[CH:8]=[CH:7][C:14]2=[C:16]([CH:6]=[CH:5][C:12]3=[C:18]2[O:23][C@H:19]2[C:13]4=[C:17]([CH:9]=[C:11]([OH:21])[CH:3]=[CH:4]4)[O:22][CH2:10][C@@H:15]32)[O:24]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0