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(3R)-vestitone

MNXM1506 is deprecated and here replaced by MNXM729355
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM729355

	#reac
in my sandbox	0
in MNXref (generic)	8
in models (compartimentalized)	1

formula

C₁₆H₁₄O₅

charge

mass

286.08412

reference

InChIKey

WQCJOKYOIJVEFN-ZDUSSCGKSA-N

InChI

InChI=1S/C16H14O5/c1-20-10-3-5-11(14(18)7-10)13-8-21-15-6-9(17)2-4-12(15)16(13)19/h2-7,13,17-18H,8H2,1H3/t13-/m0/s1

SMILES

COc1ccc([C@@H]2COc3cc(O)ccc3C2=O)c(O)c1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:16786 chebi:16786	(3R)-vestitone (3R)-7-hydroxy-3-(2-hydroxy-4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one (3R)-vestitol 2,3-Dihydro-7-hydroxy-3-(2-hydroxy-4-methoxyphenyl)-4H-1-benzopyran-4-one 7,2'-Dihydroxy-4'-methoxyisoflavanone Vestitone vestitone
kegg.compound:C00786 keggC:C00786	(-)-Vestitone Vestitone
metacyc.compound:VESTITONE metacycM:VESTITONE	(3R)-vestitone (-)-vestitone vestitone
seed.compound:cpd00582 seedM:cpd00582	Vestitone (-)-Vestitone (-)-vestitone (3R)-vestitone vestitone
chebi:15307 chebi:27284 chebi:9972 keggC:M_C00786 seedM:M_cpd00582	secondary/obsolete/fantasy identifier