cis-4-(7-Hydroxtpyren-8-yl)-2-oxobut-3-enoate

Properties Image MNX_ID MNXM11007 reference chebi:81622 formula C20H12O4 global charge 0 mol weight 316.312 InChIKey XDSTVDYTLSEQEM-HJWRWDBZSA-N InChI InChI=1S/C20H12O4/c21-16(20(23)24)9-8-14-15-7-6-12-3-1-2-11-4-5-13(10-17(14)22)19(15)18(11)12/h1-10,22H,(H,23,24)/b9-8- SMILES O=C(O)C(=O)/C=C\C1=C2C=CC3=CC=CC4=CC=C(C=C1O)C2=C34 MNX internals InChI (mnx) InChI=1/C20H12O4/c21-16(20(23)24)9-8-14-15-7-6-12-3-1-2-11-4-5-13(10-17(14)22)19(15)18(11)12/h1-10,22H,(H,23,24)/b9-8- SMILES (mnx) [CH:1]1=[CH:2][C:11]2=[CH:4][CH:5]=[C:13]3[CH:10]=[C:17]([OH:22])[C:14](/[CH:8]=[CH:9]\[C:16]([C:20]([OH:23])=[O:24])=[O:21])=[C:15]4[CH:7]=[CH:6][C:12](=[CH:3]1)[C:18]2=[C:19]34

Parent-child relations graph

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