Coriandrone B

Properties Image MNX_ID MNXM123955 reference chebi:174778 formula C16H20O5 global charge 0 mol weight 292.331 InChIKey BWHXOOBBSCGLBC-UHFFFAOYSA-N InChI InChI=1S/C16H20O5/c1-8-5-9-6-11(19-4)10-7-12(17)16(2,3)21-14(10)13(9)15(18)20-8/h6,8,12,17H,5,7H2,1-4H3 SMILES COC1=CC2=C(C(=O)OC(C)C2)C2=C1CC(O)C(C)(C)O2 MNX internals InChI (mnx) InChI=1/C16H20O5/c1-8-5-9-6-11(19-4)10-7-12(17)16(2,3)21-14(10)13(9)15(18)20-8/h6,8,12,17H,5,7H2,1-4H3/t8?,12? SMILES (mnx) [CH3:1][CH:8]1[CH2:5][C:9]2=[CH:6][C:11]([O:19][CH3:4])=[C:10]3[CH2:7][CH:12]([OH:17])[C:16]([CH3:2])([CH3:3])[O:21][C:14]3=[C:13]2[C:15](=[O:18])[O:20]1

Parent-child relations graph

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