ent-beyerene

Properties Image MNX_ID MNXM30042 reference chebi:229601 formula C20H32 global charge 0 mol weight 272.476 InChIKey GXMKKDDGINQVBE-LHDHZVESSA-N InChI InChI=1S/C20H32/c1-17(2)8-5-9-19(4)15(17)7-11-20-13-12-18(3,14-20)10-6-16(19)20/h12-13,15-16H,5-11,14H2,1-4H3/t15-,16+,18-,19-,20+/m1/s1 SMILES CC1(C)CCC[C@]2(C)[C@@H]1CC[C@@]13C=C[C@@](C)(CC[C@H]12)C3 MNX internals InChI (mnx) InChI=1/C20H32/c1-17(2)8-5-9-19(4)15(17)7-11-20-13-12-18(3,14-20)10-6-16(19)20/h12-13,15-16H,5-11,14H2,1-4H3/t15-,16+,18-,19-,20+/m1/s1 SMILES (mnx) [CH3:1][C:17]1([CH3:2])[CH2:8][CH2:5][CH2:9][C@:19]2([CH3:4])[C@@H:15]1[CH2:7][CH2:11][C@@:20]13[CH:13]=[CH:12][C@@:18]([CH3:3])([CH2:10][CH2:6][C@@H:16]21)[CH2:14]3

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 1