carbonarone A

Properties Image MNX_ID MNXM103512 reference chebi:69403 formula C13H11NO3 global charge 0 mol weight 229.235 InChIKey RQWMGMIZGOCPMP-UHFFFAOYSA-N InChI InChI=1S/C13H11NO3/c14-13(16)11-8-17-10(7-12(11)15)6-9-4-2-1-3-5-9/h1-5,7-8H,6H2,(H2,14,16) SMILES NC(=O)C1=COC(CC2=CC=CC=C2)=CC1=O MNX internals InChI (mnx) InChI=1/C13H11NO3/c14-13(16)11-8-17-10(7-12(11)15)6-9-4-2-1-3-5-9/h1-5,7-8H,6H2,(H2,14,16) SMILES (mnx) [CH:1]1=[CH:2][CH:4]=[C:9]([CH2:6][C:10]2=[CH:7][C:12](=[O:15])[C:11]([C:13](=[NH:14])[OH:16])=[CH:8][O:17]2)[CH:5]=[CH:3]1

Parent-child relations graph

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