Palustradiene

Properties Image MNX_ID MNXM6371 reference chebi:29659 formula C20H32 global charge 0 mol weight 272.476 InChIKey KEQXEEMBFONZBL-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/h13-14,18H,6-12H2,1-5H3/t18-,20+/m0/s1 SMILES CC(C)C1=CC2=C(CC1)[C@@]1(C)CCCC(C)(C)[C@@H]1CC2 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/h13-14,18H,6-12H2,1-5H3/t18-,20+/m0/s1 SMILES (mnx) [CH3:1][CH:14]([CH3:2])[C:15]1=[CH:13][C:16]2=[C:17]([CH2:9][CH2:7]1)[C@@:20]1([CH3:5])[CH2:12][CH2:6][CH2:11][C:19]([CH3:3])([CH3:4])[C@@H:18]1[CH2:10][CH2:8]2

Parent-child relations graph

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