obtusafuran

Properties Image MNX_ID MNXM107346 reference chebi:66804 formula C16H16O3 global charge 0 mol weight 256.301 InChIKey FRERFZXINXYHDY-QLJPJBMISA-N InChI InChI=1S/C16H16O3/c1-10-12-8-13(17)15(18-2)9-14(12)19-16(10)11-6-4-3-5-7-11/h3-10,16-17H,1-2H3/t10-,16-/m1/s1 SMILES COC1=CC2=C(C=C1O)[C@@H](C)[C@H](C1=CC=CC=C1)O2 MNX internals InChI (mnx) InChI=1/C16H16O3/c1-10-12-8-13(17)15(18-2)9-14(12)19-16(10)11-6-4-3-5-7-11/h3-10,16-17H,1-2H3/t10-,16-/m1/s1 SMILES (mnx) [CH3:1][C@@H:10]1[C:12]2=[CH:8][C:13]([OH:17])=[C:15]([O:18][CH3:2])[CH:9]=[C:14]2[O:19][C@H:16]1[C:11]1=[CH:6][CH:4]=[CH:3][CH:5]=[CH:7]1

Parent-child relations graph

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