7,12-Dimethylbenz[a]anthracene 5,6-oxide

Properties Image MNX_ID MNXM10395 reference chebi:82590 formula C20H16O global charge 0 mol weight 272.347 InChIKey HVGNLIKFFBYBQM-UHFFFAOYSA-N InChI InChI=1S/C20H16O/c1-11-13-7-3-4-8-14(13)12(2)18-17(11)15-9-5-6-10-16(15)19-20(18)21-19/h3-10,19-20H,1-2H3 SMILES CC1=C2C3=C(C=CC=C3)C3OC3C2=C(C)C2=CC=CC=C21 MNX internals InChI (mnx) InChI=1/C20H16O/c1-11-13-7-3-4-8-14(13)12(2)18-17(11)15-9-5-6-10-16(15)19-20(18)21-19/h3-10,19-20H,1-2H3/t19?,20? SMILES (mnx) [CH3:1][C:11]1=[C:17]2[C:15]3=[CH:9][CH:5]=[CH:6][CH:10]=[C:16]3[CH:19]3[CH:20]([C:18]2=[C:12]([CH3:2])[C:14]2=[CH:8][CH:4]=[CH:3][CH:7]=[C:13]12)[O:21]3

Parent-child relations graph

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