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licocoumarone

Properties

Image

Occurences in reactions

MNX_ID

MNXM106180

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

formula

C₂₀H₂₀O₅

charge

mass

340.13107

reference

InChIKey

CNPMAFLUEHEXRE-UHFFFAOYSA-N

InChI

InChI=1S/C20H20O5/c1-11(2)4-6-14-17(23)10-19-15(20(14)24-3)9-18(25-19)13-7-5-12(21)8-16(13)22/h4-5,7-10,21-23H,6H2,1-3H3

SMILES

COc1c(CC=C(C)C)c(O)cc2oc(-c3ccc(O)cc3O)cc12

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:69098 chebi:69098	licocoumarone 2-(2',4'-dihydroxyphenyl)-6-hydroxy-5-isopentenyl-4-methoxybenzofuran 4-[6-hydroxy-4-methoxy-5-(3-methylbut-2-en-1-yl)-1-benzofuran-2-yl]benzene-1,3-diol
lipidmaps:LMPK12160045 lipidmapsM:LMPK12160045	Licocoumarone
hmdb:HMDB0038755	Licocoumarone 2-(2',4'-Dihydroxyphenyl)-6-hydroxy-5-isopentenyl-4-methoxybenzofuran 2-(3,4-Dihydroxyphenyl)-6-hydroxy-4-methoxy-5-prenylbenzofuran 4-[6-Hydroxy-4-methoxy-5-(3-methyl-2-butenyl)-2-benzofuranyl]-1,3-benzenediol, 9ci 4-[6-hydroxy-4-methoxy-5-(3-methylbut-2-en-1-yl)-1-benzofuran-2-yl]benzene-1,3-diol Benzyl(2-hydroxyethyl)dimethylammonium hydroxide Benzyl(2-hydroxyethyl)dimethylammonium, hydroxide licocoumarone
hmdb:HMDB38755	secondary/obsolete/fantasy identifier