7-Hydroxymethyl-12-methylbenz[a]anthracene

Properties Image MNX_ID MNXM10421 reference chebi:82559 formula C20H16O global charge 0 mol weight 272.347 InChIKey JCBBZYDVQJQMMB-UHFFFAOYSA-N InChI InChI=1S/C20H16O/c1-13-15-7-4-5-9-17(15)19(12-21)18-11-10-14-6-2-3-8-16(14)20(13)18/h2-11,21H,12H2,1H3 SMILES CC1=C2C3=C(C=CC=C3)C=CC2=C(CO)C2=CC=CC=C21 MNX internals InChI (mnx) InChI=1/C20H16O/c1-13-15-7-4-5-9-17(15)19(12-21)18-11-10-14-6-2-3-8-16(14)20(13)18/h2-11,21H,12H2,1H3 SMILES (mnx) [CH3:1][C:13]1=[C:20]2[C:16]3=[CH:8][CH:3]=[CH:2][CH:6]=[C:14]3[CH:10]=[CH:11][C:18]2=[C:19]([CH2:12][OH:21])[C:17]2=[CH:9][CH:5]=[CH:4][CH:7]=[C:15]12

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0