yahyaxanthone

Properties Image MNX_ID MNXM113994 reference chebi:66491 formula C22H22O8 global charge 0 mol weight 414.41 InChIKey BSWKVMNQZNMVIO-UHFFFAOYSA-N InChI InChI=1S/C22H22O8/c1-22(2)8-7-10-17-14(16(24)21(28-6)18(10)30-22)15(23)13-11(25-3)9-12(26-4)19(27-5)20(13)29-17/h7-9,24H,1-6H3 SMILES COC1=CC(OC)=C2C(=O)C3=C(OC2=C1OC)C1=C(OC(C)(C)C=C1)C(OC)=C3O MNX internals InChI (mnx) InChI=1/C22H22O8/c1-22(2)8-7-10-17-14(16(24)21(28-6)18(10)30-22)15(23)13-11(25-3)9-12(26-4)19(27-5)20(13)29-17/h7-9,24H,1-6H3 SMILES (mnx) [CH3:1][C:22]1([CH3:2])[CH:8]=[CH:7][C:10]2=[C:17]3[C:14](=[C:16]([OH:24])[C:21]([O:28][CH3:6])=[C:18]2[O:30]1)[C:15](=[O:23])[C:13]1=[C:20]([C:19]([O:27][CH3:5])=[C:12]([O:26][CH3:4])[CH:9]=[C:11]1[O:25][CH3:3])[O:29]3

Parent-child relations graph

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