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3'-O-methylepicatechin

Properties

Image

Occurences in reactions

MNX_ID

MNXM101753

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

formula

C₁₆H₁₆O₆

charge

mass

304.09469

reference

InChIKey

NJHJXXLBWQXMRO-CZUORRHYSA-N

InChI

InChI=1S/C16H16O6/c1-21-15-4-8(2-3-11(15)18)16-13(20)7-10-12(19)5-9(17)6-14(10)22-16/h2-6,13,16-20H,7H2,1H3/t13-,16-/m1/s1

SMILES

COc1cc([C@H]2Oc3cc(O)cc(O)c3C[C@H]2O)ccc1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:70254 chebi:70254	3'-O-methylepicatechin (2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol Symplocosidin
hmdb:HMDB0029175	3'-O-methyl-(-)-epicatechin (2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol 3'-O-Methylepicatechin symplocosidin
lipidmaps:LMPK12020111 lipidmapsM:LMPK12020111	Symplocosidin
hmdb:HMDB29175	secondary/obsolete/fantasy identifier