19-hydroxytetrangulol

Properties Image MNX_ID MNXM6655 reference chebi:31063 formula C19H12O5 global charge 0 mol weight 320.3 InChIKey QPPVCGOBYRQSAG-UHFFFAOYSA-N InChI InChI=1S/C19H12O5/c20-8-9-6-10-4-5-12-17(15(10)14(22)7-9)19(24)11-2-1-3-13(21)16(11)18(12)23/h1-7,20-22H,8H2 SMILES O=C1C2=CC=C3C=C(CO)C=C(O)C3=C2C(=O)C2=CC=CC(O)=C12 MNX internals InChI (mnx) InChI=1/C19H12O5/c20-8-9-6-10-4-5-12-17(15(10)14(22)7-9)19(24)11-2-1-3-13(21)16(11)18(12)23/h1-7,20-22H,8H2 SMILES (mnx) [CH:1]1=[CH:2][C:11]2=[C:16]([C:13]([OH:21])=[CH:3]1)[C:18](=[O:23])[C:12]1=[C:17]([C:15]3=[C:10]([CH:4]=[CH:5]1)[CH:6]=[C:9]([CH2:8][OH:20])[CH:7]=[C:14]3[OH:22])[C:19]2=[O:24]

Parent-child relations graph

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