erylatissin A

Properties Image MNX_ID MNXM104919 reference chebi:65863 formula C21H20O5 global charge 0 mol weight 352.386 InChIKey CEXYMYPXHMUTTJ-UHFFFAOYSA-N InChI InChI=1S/C21H20O5/c1-12(2)4-5-13-8-14(9-18(23)21(13)25-3)17-11-26-19-10-15(22)6-7-16(19)20(17)24/h4,6-11,22-23H,5H2,1-3H3 SMILES COC1=C(CC=C(C)C)C=C(C2=COC3=CC(O)=CC=C3C2=O)C=C1O MNX internals InChI (mnx) InChI=1/C21H20O5/c1-12(2)4-5-13-8-14(9-18(23)21(13)25-3)17-11-26-19-10-15(22)6-7-16(19)20(17)24/h4,6-11,22-23H,5H2,1-3H3 SMILES (mnx) [CH3:1][C:12]([CH3:2])=[CH:4][CH2:5][C:13]1=[CH:8][C:14]([C:17]2=[CH:11][O:26][C:19]3=[C:16]([CH:7]=[CH:6][C:15]([OH:22])=[CH:10]3)[C:20]2=[O:24])=[CH:9][C:18]([OH:23])=[C:21]1[O:25][CH3:3]

Parent-child relations graph

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