9beta-stemod-13(17)-en-19-al

Properties Image MNX_ID MNXM147891 reference metacycM:CPD-16680 formula C20H30O global charge 0 mol weight 286.459 InChIKey YQYYGHCVTSEEQC-YDRVBMSGSA-N InChI InChI=1S/C20H30O/c1-14-7-10-20-12-15(14)11-16(20)5-6-17-18(2,13-21)8-4-9-19(17,20)3/h13,15-17H,1,4-12H2,2-3H3/t15-,16-,17-,18+,19-,20+/m0/s1 SMILES C=C1CC[C@@]23C[C@@H]1C[C@@H]2CC[C@H]1[C@@](C)(C=O)CCC[C@@]13C MNX internals InChI (mnx) InChI=1/C20H30O/c1-14-7-10-20-12-15(14)11-16(20)5-6-17-18(2,13-21)8-4-9-19(17,20)3/h13,15-17H,1,4-12H2,2-3H3/t15-,16-,17-,18+,19-,20+/m0/s1 SMILES (mnx) [CH2:1]=[C:14]1[CH2:7][CH2:10][C@@:20]23[CH2:12][C@@H:15]1[CH2:11][C@@H:16]2[CH2:5][CH2:6][C@H:17]1[C@@:18]([CH3:2])([CH:13]=[O:21])[CH2:8][CH2:4][CH2:9][C@@:19]13[CH3:3]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 4 in models (compartimentalized) 0