miltiradiene

Properties Image MNX_ID MNXM97168 reference chebi:65037 formula C20H32 global charge 0 mol weight 272.476 InChIKey BGVUIJDZTQIJIO-AZUAARDMSA-N InChI InChI=1S/C20H32/c1-14(2)15-7-9-17-16(13-15)8-10-18-19(3,4)11-6-12-20(17,18)5/h7,14,18H,6,8-13H2,1-5H3/t18-,20+/m0/s1 SMILES CC(C)C1=CCC2=C(CC[C@H]3C(C)(C)CCC[C@]23C)C1 MNX internals InChI (mnx) InChI=1/C20H32/c1-14(2)15-7-9-17-16(13-15)8-10-18-19(3,4)11-6-12-20(17,18)5/h7,14,18H,6,8-13H2,1-5H3/t18-,20+/m0/s1 SMILES (mnx) [CH3:1][CH:14]([CH3:2])[C:15]1=[CH:7][CH2:9][C:17]2=[C:16]([CH2:8][CH2:10][C@H:18]3[C:19]([CH3:3])([CH3:4])[CH2:11][CH2:6][CH2:12][C@:20]23[CH3:5])[CH2:13]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 8 in models (compartimentalized) 0