13-epi manoyl oxide

Properties Image MNX_ID MNXM14001 reference metacycM:CPD-12751 formula C20H34O global charge 0 mol weight 290.491 InChIKey IGGWKHQYMAJOHK-DBYSVDLZSA-N InChI InChI=1S/C20H34O/c1-7-18(4)13-9-16-19(5)12-8-11-17(2,3)15(19)10-14-20(16,6)21-18/h7,15-16H,1,8-14H2,2-6H3/t15?,16?,18-,19+,20-/m1/s1 SMILES C=C[C@]1(C)CCC2[C@@]3(C)CCCC(C)(C)C3CC[C@@]2(C)O1 MNX internals InChI (mnx) InChI=1/C20H34O/c1-7-18(4)13-9-16-19(5)12-8-11-17(2,3)15(19)10-14-20(16,6)21-18/h7,15-16H,1,8-14H2,2-6H3/t15?,16?,18-,19+,20-/m1/s1 SMILES (mnx) [CH2:1]=[CH:7][C@:18]1([CH3:4])[CH2:13][CH2:9][CH:16]2[C@@:19]3([CH3:5])[CH2:12][CH2:8][CH2:11][C:17]([CH3:2])([CH3:3])[CH:15]3[CH2:10][CH2:14][C@@:20]2([CH3:6])[O:21]1

Parent-child relations graph

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