Pyrene-1,2-oxide

Properties Image MNX_ID MNXM12820 reference chebi:81618 formula C16H10O global charge 0 mol weight 218.255 InChIKey IRYBKFGKUNZRSI-UHFFFAOYSA-N InChI InChI=1S/C16H10O/c1-2-9-4-5-11-8-13-16(17-13)12-7-6-10(3-1)14(9)15(11)12/h1-8,13,16H SMILES C1=CC2=C3C(=C1)C=CC1=CC4OC4C(=C13)C=C2 MNX internals InChI (mnx) InChI=1/C16H10O/c1-2-9-4-5-11-8-13-16(17-13)12-7-6-10(3-1)14(9)15(11)12/h1-8,13,16H/t13?,16? SMILES (mnx) [CH:1]1=[CH:2][C:9]2=[C:14]3[C:10](=[CH:3]1)[CH:6]=[CH:7][C:12]1=[C:15]3[C:11](=[CH:8][CH:13]3[CH:16]1[O:17]3)[CH:5]=[CH:4]2

Parent-child relations graph

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