Digiferrugineol

Properties Image MNX_ID MNXM50680 reference chebi:4544 formula C15H10O4 global charge 0 mol weight 254.241 InChIKey JCZCSQSSSAHDCB-UHFFFAOYSA-N InChI InChI=1S/C15H10O4/c16-7-8-5-6-11-12(13(8)17)15(19)10-4-2-1-3-9(10)14(11)18/h1-6,16-17H,7H2 SMILES O=C1C2=CC=CC=C2C(=O)C2=C1C=CC(CO)=C2O MNX internals InChI (mnx) InChI=1/C15H10O4/c16-7-8-5-6-11-12(13(8)17)15(19)10-4-2-1-3-9(10)14(11)18/h1-6,16-17H,7H2 SMILES (mnx) [CH:1]1=[CH:2][CH:4]=[C:10]2[C:9](=[CH:3]1)[C:14](=[O:18])[C:11]1=[CH:6][CH:5]=[C:8]([CH2:7][OH:16])[C:13]([OH:17])=[C:12]1[C:15]2=[O:19]

Parent-child relations graph

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