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Conyzatin

PropertiesImage
MNX_IDMNXM47616 Image of MNXM47616
referencelipidmapsM:LMPK12113277
formulaC20H20O9
global charge0
mol weight404.371
InChIKeyWFUOMXZWZFSZEM-UHFFFAOYSA-N
InChIInChI=1S/C20H20O9/c1-24-12-6-9(7-13(25-2)18(12)27-4)16-20(28-5)15(23)14-10(21)8-11(22)17(26-3)19(14)29-16/h6-8,21-22H,1-5H3
SMILESCOC1=CC(C2=C(OC)C(=O)C3=C(O2)C(OC)=C(O)C=C3O)=CC(OC)=C1OC
MNX internals
InChI (mnx)InChI=1/C20H20O9/c1-24-12-6-9(7-13(25-2)18(12)27-4)16-20(28-5)15(23)14-10(21)8-11(22)17(26-3)19(14)29-16/h6-8,21-22H,1-5H3 Image of MNXM47616
SMILES (mnx)[CH3:1][O:24][C:12]1=[C:18]([O:27][CH3:4])[C:13]([O:25][CH3:2])=[CH:7][C:9]([C:16]2=[C:20]([O:28][CH3:5])[C:15](=[O:23])[C:14]3=[C:19]([C:17]([O:26][CH3:3])=[C:11]([OH:22])[CH:8]=[C:10]3[OH:21])[O:29]2)=[CH:6]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

lipidmaps:LMPK12113277
lipidmapsM:LMPK12113277
WFUOMXZWZFSZEM-UHFFFAOYSA-N 		Conyzatin