pseudoneolinderane

Properties Image MNX_ID MNXM108302 reference chebi:69075 formula C15H16O4 global charge 0 mol weight 260.289 InChIKey NJMLHRWYACXVHJ-GMXABZIVSA-N InChI InChI=1S/C15H16O4/c1-8-7-17-11-6-15(2)12(19-15)4-3-9-5-10(13(8)11)18-14(9)16/h5,7,10,12H,3-4,6H2,1-2H3/t10-,12+,15+/m1/s1 SMILES CC1=COC2=C1[C@H]1C=C(CC[C@@H]3O[C@@]3(C)C2)C(=O)O1 MNX internals InChI (mnx) InChI=1/C15H16O4/c1-8-7-17-11-6-15(2)12(19-15)4-3-9-5-10(13(8)11)18-14(9)16/h5,7,10,12H,3-4,6H2,1-2H3/t10-,12+,15+/m1/s1 SMILES (mnx) [CH3:1][C:8]1=[CH:7][O:17][C:11]2=[C:13]1[C@H:10]1[CH:5]=[C:9]([CH2:3][CH2:4][C@H:12]3[C@:15]([CH3:2])([CH2:6]2)[O:19]3)[C:14](=[O:16])[O:18]1

Parent-child relations graph

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