(ent-16betaOH)-16,17-Dihydroxy-9(11)-kauren-19-oic acid

Properties Image MNX_ID MNXM115317 reference chebi:191672 formula C20H30O4 global charge 0 mol weight 334.456 InChIKey QSJIZGQGHYROGD-UHFFFAOYSA-N InChI InChI=1S/C20H30O4/c1-17-7-3-8-18(2,16(22)23)14(17)6-9-19-10-13(4-5-15(17)19)20(24,11-19)12-21/h5,13-14,21,24H,3-4,6-12H2,1-2H3,(H,22,23) SMILES CC1(C(=O)O)CCCC2(C)C3=CCC4CC3(CCC12)CC4(O)CO MNX internals InChI (mnx) InChI=1/C20H30O4/c1-17-7-3-8-18(2,16(22)23)14(17)6-9-19-10-13(4-5-15(17)19)20(24,11-19)12-21/h5,13-14,21,24H,3-4,6-12H2,1-2H3,(H,22,23)/t13?,14?,17?,18?,19?,20? SMILES (mnx) [CH3:1][C:17]12[CH2:7][CH2:3][CH2:8][C:18]([CH3:2])([C:16](=[O:22])[OH:23])[CH:14]1[CH2:6][CH2:9][C:19]13[CH2:10][CH:13]([CH2:4][CH:5]=[C:15]21)[C:20]([CH2:12][OH:21])([OH:24])[CH2:11]3

Parent-child relations graph

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