tetrangulol

Properties Image MNX_ID MNXM5307 reference chebi:32212 formula C19H12O4 global charge 0 mol weight 304.301 InChIKey NFUYRESOTVGLRL-UHFFFAOYSA-N InChI InChI=1S/C19H12O4/c1-9-7-10-5-6-12-17(15(10)14(21)8-9)19(23)11-3-2-4-13(20)16(11)18(12)22/h2-8,20-21H,1H3 SMILES CC1=CC2=CC=C3C(=O)C4=C(O)C=CC=C4C(=O)C3=C2C(O)=C1 MNX internals InChI (mnx) InChI=1/C19H12O4/c1-9-7-10-5-6-12-17(15(10)14(21)8-9)19(23)11-3-2-4-13(20)16(11)18(12)22/h2-8,20-21H,1H3 SMILES (mnx) [CH3:1][C:9]1=[CH:7][C:10]2=[C:15]([C:14]([OH:21])=[CH:8]1)[C:17]1=[C:12]([CH:6]=[CH:5]2)[C:18](=[O:22])[C:16]2=[C:11]([CH:3]=[CH:2][CH:4]=[C:13]2[OH:20])[C:19]1=[O:23]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0