1alpha-hydroxy-maackiain

Properties Image MNX_ID MNXM148609 reference metacycM:CPD-17457 formula C16H12O6 global charge 0 mol weight 300.266 InChIKey OUWPRTKEQQGVLY-DYIOSXRMSA-N InChI InChI=1S/C16H12O6/c17-8-1-2-16(18)14(3-8)19-6-10-9-4-12-13(21-7-20-12)5-11(9)22-15(10)16/h1-5,10,15,18H,6-7H2/t10-,15+,16?/m0/s1 SMILES O=C1C=CC2(O)C(=C1)OC[C@H]1C3=CC4=C(C=C3O[C@H]12)OCO4 MNX internals InChI (mnx) InChI=1/C16H12O6/c17-8-1-2-16(18)14(3-8)19-6-10-9-4-12-13(21-7-20-12)5-11(9)22-15(10)16/h1-5,10,15,18H,6-7H2/t10-,15+,16?/m0/s1 SMILES (mnx) [CH:1]1=[CH:2][C:16]2([OH:18])[C:14](=[CH:3][C:8]1=[O:17])[O:19][CH2:6][C@H:10]1[C:9]3=[CH:4][C:12]4=[C:13]([CH:5]=[C:11]3[O:22][C@H:15]12)[O:21][CH2:7][O:20]4

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0