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7-O-methylvitexin 2''-O-alpha-L-rhamnoside

Properties

Image

Occurences in reactions

MNX_ID

MNXM1376509

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₂₈H₃₂O₁₄

charge

mass

592.55

reference

chebi:31143

InChIKey

HFUYHHROXLKXRR-WBXLRLGPSA-N

InChI

InChI=1S/C28H32O14/c1-10-20(33)22(35)24(37)28(39-10)42-27-23(36)21(34)17(9-29)41-26(27)19-16(38-2)8-14(32)18-13(31)7-15(40-25(18)19)11-3-5-12(30)6-4-11/h3-8,10,17,20-24,26-30,32-37H,9H2,1-2H3/t10-,17+,20-,21+,22+,23-,24+,26-,27+,28-/m0/s1

SMILES

[CH3:1][C@H:10]1[C@H:20]([OH:33])[C@@H:22]([OH:35])[C@@H:24]([OH:37])[C@H:28]([O:42][C@@H:27]2[C@@H:23]([OH:36])[C@H:21]([OH:34])[C@@H:17]([CH2:9][OH:29])[O:41][C@H:26]2[c:19]2[c:16]([O:38][CH3:2])[cH:8][c:14]([OH:32])[c:18]3[c:13](=[O:31])[cH:7][c:15](-[c:11]4[cH:3][cH:5][c:12]([OH:30])[cH:6][cH:4]4)[o:40][c:25]32)[O:39]1

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Similar chemical compounds in external resources
Identifier	Description
CHEBI:31143 chebi:31143	7-O-methylvitexin 2''-O-alpha-L-rhamnoside (1S)-1,5-anhydro-2-O-(6-deoxy-alpha-L-mannopyranosyl)-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-7-methoxy-4-oxo-4H-chromen-8-yl]-D-glucitol (1S)-1,5-anhydro-2-O-(alpha-L-rhamnopyranosyl)-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-7-methoxy-4-oxo-4H-chromen-8-yl]-D-glucitol 2''-O-Rhamnosylisoswertisin 7-O-Methylvitexin 2''-O-beta-L-rhamnoside Isoswertisin 2''-rhamnoside
sabiork.compound:14660 sabiorkM:14660	7-O-Methylvitexin 2''-O-beta-L-rhamnoside 2''-O-Rhamnosylisoswertisin Isoswertisin 2''-rhamnoside
CHEBI:77809 chebi:77809	7-O-methylvitexin 2''-O-alpha-L-rhamnoside(1-) (1S)-1,5-anhydro-2-O-(6-deoxy-alpha-L-mannopyranosyl)-1-[2-(4-hydroxyphenyl)-7-methoxy-5-oxido-4-oxo-4H-chromen-8-yl]-D-glucitol
lipidmaps:LMPK12110990 lipidmapsM:LMPK12110990	Isoswertisin 2''-O-rhamnoside
kegg.compound:C12629 keggC:C12629	Isoswertisin 2''-rhamnoside 2''-O-Rhamnosylisoswertisin 7-O-Methylvitexin 2''-O-beta-L-rhamnoside
keggC:M_C12629	secondary/obsolete/fantasy identifier