(-)-Sophorol

Properties Image MNX_ID MNXM5353 reference chebi:80395 formula C16H12O6 global charge 0 mol weight 300.266 InChIKey FAPWSAQOVOBPCP-NSHDSACASA-N InChI InChI=1S/C16H12O6/c17-8-1-2-9-13(3-8)20-6-11(16(9)19)10-4-14-15(5-12(10)18)22-7-21-14/h1-5,11,17-18H,6-7H2/t11-/m0/s1 SMILES O=C1C2=CC=C(O)C=C2OC[C@H]1C1=C(O)C=C2OCOC2=C1 MNX internals InChI (mnx) InChI=1/C16H12O6/c17-8-1-2-9-13(3-8)20-6-11(16(9)19)10-4-14-15(5-12(10)18)22-7-21-14/h1-5,11,17-18H,6-7H2/t11-/m0/s1 SMILES (mnx) [CH:1]1=[CH:2][C:9]2=[C:13]([CH:3]=[C:8]1[OH:17])[O:20][CH2:6][C@@H:11]([C:10]1=[CH:4][C:14]3=[C:15]([CH:5]=[C:12]1[OH:18])[O:22][CH2:7][O:21]3)[C:16]2=[O:19]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 4 in models (compartimentalized) 0