(+)-(13S)-kolavelool

Properties Image MNX_ID MNXM116198 reference metacycM:CPD-20434 formula C20H34O global charge 0 mol weight 290.491 InChIKey YBDUXZKWDIUNSG-OMQSBVIBSA-N InChI InChI=1S/C20H34O/c1-7-18(4,21)13-14-20(6)16(3)11-12-19(5)15(2)9-8-10-17(19)20/h7,9,16-17,21H,1,8,10-14H2,2-6H3/t16-,17+,18+,19+,20+/m0/s1 SMILES C=C[C@@](C)(O)CC[C@]1(C)[C@@H](C)CC[C@]2(C)C(C)=CCC[C@@H]12 MNX internals InChI (mnx) InChI=1/C20H34O/c1-7-18(4,21)13-14-20(6)16(3)11-12-19(5)15(2)9-8-10-17(19)20/h7,9,16-17,21H,1,8,10-14H2,2-6H3/t16-,17+,18+,19+,20+/m0/s1 SMILES (mnx) [CH2:1]=[CH:7][C@:18]([CH3:4])([CH2:13][CH2:14][C@:20]1([CH3:6])[C@@H:16]([CH3:3])[CH2:11][CH2:12][C@:19]2([CH3:5])[C:15]([CH3:2])=[CH:9][CH2:8][CH2:10][C@H:17]21)[OH:21]

Parent-child relations graph

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