(14E,18E)-lycopadiene

Properties Image MNX_ID MNXM19117 reference chebi:142539 formula C40H78 global charge 0 mol weight 559.064 InChIKey JBDZFQFIKGPIRH-PQPPKSKMSA-N InChI InChI=1S/C40H78/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h21-22,33-34,37-40H,11-20,23-32H2,1-10H3/b35-21+,36-22+/t37-,38-,39+,40+/m1/s1 SMILES C/C(=C\CC/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C MNX internals InChI (mnx) InChI=1/C40H78/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h21-22,33-34,37-40H,11-20,23-32H2,1-10H3/b35-21+,36-22+/t37-,38-,39+,40+/m1/s1 SMILES (mnx) [CH3:1][CH:33]([CH3:2])[CH2:19][CH2:13][CH2:23][C@@H:37]([CH3:7])[CH2:27][CH2:17][CH2:31][C@@H:39]([CH3:9])[CH2:29][CH2:15][CH2:25]/[C:35]([CH3:5])=[CH:21]/[CH2:11][CH2:12]/[CH:22]=[C:36](\[CH3:6])[CH2:26][CH2:16][CH2:30][C@H:40]([CH3:10])[CH2:32][CH2:18][CH2:28][C@H:38]([CH3:8])[CH2:24][CH2:14][CH2:20][CH:34]([CH3:3])[CH3:4]

Parent-child relations graph

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