(S,S)-traseolide

Properties Image MNX_ID MNXM31907 reference chebi:63780 formula C18H26O global charge 0 mol weight 258.405 InChIKey IMRYETFJNLKUHK-SJCJKPOMSA-N InChI InChI=1S/C18H26O/c1-10(2)17-12(4)18(6,7)16-8-11(3)14(13(5)19)9-15(16)17/h8-10,12,17H,1-7H3/t12-,17-/m0/s1 SMILES CC(=O)C1=C(C)C=C2C(=C1)[C@@H](C(C)C)[C@H](C)C2(C)C MNX internals InChI (mnx) InChI=1/C18H26O/c1-10(2)17-12(4)18(6,7)16-8-11(3)14(13(5)19)9-15(16)17/h8-10,12,17H,1-7H3/t12-,17-/m0/s1 SMILES (mnx) [CH3:1][CH:10]([CH3:2])[C@H:17]1[C@H:12]([CH3:4])[C:18]([CH3:6])([CH3:7])[C:16]2=[C:15]1[CH:9]=[C:14]([C:13]([CH3:5])=[O:19])[C:11]([CH3:3])=[CH:8]2

Parent-child relations graph

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