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(6aS,11aS)-2-dimethylallyl-3,6a,9-trihydroxypterocarpan

Properties

Image

Occurences in reactions

MNX_ID

MNXM1510

	#reac
in my sandbox	0
in MNXref (generic)	14
in models (compartimentalized)	1

formula

C₂₀H₂₀O₅

charge

mass

340.13107

reference

InChIKey

TUXXPRXOVFCNPC-VQTJNVASSA-N

InChI

InChI=1S/C20H20O5/c1-11(2)3-4-12-7-14-17(9-16(12)22)24-10-20(23)15-6-5-13(21)8-18(15)25-19(14)20/h3,5-9,19,21-23H,4,10H2,1-2H3/t19-,20+/m0/s1

SMILES

CC(C)=CCc1cc2c(cc1O)OC[C@@]1(O)c3ccc(O)cc3O[C@@H]21

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:50118 chebi:50118	(6aS,11aS)-2-dimethylallyl-3,6a,9-trihydroxypterocarpan (+)-2-dimethylallyl-3,6a,9-trihydroxypterocarpan (6aS,11aS)-2-(3-methylbut-2-en-1-yl)-6H-[1]benzofuro[3,2-c]chromene-3,6a,9(11aH)-triol 2-Dimethylallyl-(6aS,11aS)-3,6a,9-trihydroxypterocarpan 2-dimethylallylglycinol Glyceocarpin pterocarpan glyceocarpin
lipidmaps:LMPK12070004 lipidmapsM:LMPK12070004	(6aS,11aS)-2-dimethylallyl-3,6a,9-trihydroxypterocarpan (6aS,11aS)-2-(3-methylbut-2-en-1-yl)-6H-[1]benzofuro[3,2-c]chromene-3,6a,9(11aH)-triol 2-Dimethylallyl-(6aS,11aS)-3,6a,9-trihydroxypterocarpan 2-dimethylallylglycinol Glyceocarpin
metacyc.compound:CPD-4404 metacycM:CPD-4404	(6alphaS,11alphaS)-2-dimethylallyl-3,6alpha,9-trihydroxypterocarpan (+)-2-dimethylallyl-3,6a,9-trihydroxypterocarpan 2-(6alphaS,11alphaS)-dimethylallyl-3,6alpha,9-trihydroxypterocarpan 2-dimethylallyl-(6aS,11aS)-3,6a,9-trihydroxypterocarpan Glyceocarpin
seed.compound:cpd11189 seedM:cpd11189	Glyceocarpin (+)-2-dimethylallyl-3,6a,9-trihydroxypterocarpan (6alphaS,11alphaS)-2-dimethylallyl-3,6alpha,9-trihydroxypterocarpan 2-Dimethylallyl-(6aS,11aS)-3,6a,9-trihydroxypterocarpan 2-dimethylallyl-(6aS,11aS)-3,6a,9-trihydroxypterocarpan
kegg.compound:C15509 keggC:C15509	Glyceocarpin 2-Dimethylallyl-(6aS,11aS)-3,6a,9-trihydroxypterocarpan
keggC:M_C15509 seedM:M_cpd11189	secondary/obsolete/fantasy identifier