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4'-O-methylepigallocatechin

PropertiesImage
MNX_IDMNXM101933 Image of MNXM101933
referencechebi:70253
formulaC16H16O7
global charge0
mol weight320.297
InChIKeyITDYPNOEEHONAH-UKRRQHHQSA-N
InChIInChI=1S/C16H16O7/c1-22-16-11(19)2-7(3-12(16)20)15-13(21)6-9-10(18)4-8(17)5-14(9)23-15/h2-5,13,15,17-21H,6H2,1H3/t13-,15-/m1/s1
SMILESCOC1=C(O)C=C([C@H]2OC3=C(C[C@H]2O)C(O)=CC(O)=C3)C=C1O
MNX internals
InChI (mnx)InChI=1/C16H16O7/c1-22-16-11(19)2-7(3-12(16)20)15-13(21)6-9-10(18)4-8(17)5-14(9)23-15/h2-5,13,15,17-21H,6H2,1H3/t13-,15-/m1/s1 Image of MNXM101933
SMILES (mnx)[CH3:1][O:22][C:16]1=[C:11]([OH:19])[CH:2]=[C:7]([C@@H:15]2[C@H:13]([OH:21])[CH2:6][C:9]3=[C:10]([OH:18])[CH:4]=[C:8]([OH:17])[CH:5]=[C:14]3[O:23]2)[CH:3]=[C:12]1[OH:20]
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

CHEBI:70253
chebi:70253
ITDYPNOEEHONAH-UKRRQHHQSA-N 		4'-O-methylepigallocatechin
(2R,3R)-2-(3,5-dihydroxy-4-methoxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol
Ourateacatechin
hmdb:HMDB0303923
ITDYPNOEEHONAH-UKRRQHHQSA-N 		4'-Methylepigallocatechin
(2R,3R)-2-(3,5-dihydroxy-4-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol
4'-MeEGC
4'-O-Methyl-epigallocatechin
4'-O-Methylepigallocatechin
Ouratea-catechin
ourateacatechin

lipidmaps:LMPK12020134
lipidmapsM:LMPK12020134
ITDYPNOEEHONAH-UKRRQHHQSA-N 		Ourateacatechin