(-)-haematoxylin

Properties Image MNX_ID MNXM30298 reference chebi:51684 formula C16H14O6 global charge 0 mol weight 302.282 InChIKey WZUVPPKBWHMQCE-CJNGLKHVSA-N InChI InChI=1S/C16H14O6/c17-10-2-1-8-13-9-4-12(19)11(18)3-7(9)5-16(13,21)6-22-15(8)14(10)20/h1-4,13,17-21H,5-6H2/t13-,16+/m1/s1 SMILES OC1=CC2=C(C=C1O)[C@H]1C3=CC=C(O)C(O)=C3OC[C@@]1(O)C2 MNX internals InChI (mnx) InChI=1/C16H14O6/c17-10-2-1-8-13-9-4-12(19)11(18)3-7(9)5-16(13,21)6-22-15(8)14(10)20/h1-4,13,17-21H,5-6H2/t13-,16+/m1/s1 SMILES (mnx) [CH:1]1=[CH:2][C:10]([OH:17])=[C:14]([OH:20])[C:15]2=[C:8]1[C@@H:13]1[C:9]3=[CH:4][C:12]([OH:19])=[C:11]([OH:18])[CH:3]=[C:7]3[CH2:5][C@:16]1([OH:21])[CH2:6][O:22]2

Parent-child relations graph

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