12alpha-Hydroxymunduserone

Properties Image MNX_ID MNXM33288 reference chebi:175596 formula C19H18O7 global charge 0 mol weight 358.346 InChIKey APAWOEBSLLGWDF-UHFFFAOYSA-N InChI InChI=1S/C19H18O7/c1-22-10-4-5-11-13(6-10)26-17-9-25-14-8-16(24-3)15(23-2)7-12(14)19(17,21)18(11)20/h4-8,17,21H,9H2,1-3H3 SMILES COC1=CC2=C(C=C1)C(=O)C1(O)C3=C(C=C(OC)C(OC)=C3)OCC1O2 MNX internals InChI (mnx) InChI=1/C19H18O7/c1-22-10-4-5-11-13(6-10)26-17-9-25-14-8-16(24-3)15(23-2)7-12(14)19(17,21)18(11)20/h4-8,17,21H,9H2,1-3H3/t17?,19? SMILES (mnx) [CH3:1][O:22][C:10]1=[CH:6][C:13]2=[C:11]([CH:5]=[CH:4]1)[C:18](=[O:20])[C:19]1([OH:21])[C:12]3=[CH:7][C:15]([O:23][CH3:2])=[C:16]([O:24][CH3:3])[CH:8]=[C:14]3[O:25][CH2:9][CH:17]1[O:26]2

Parent-child relations graph

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