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2-Cinnamoyl-1-galloyl-beta-D-glucopyranose

Properties

Image

Occurences in reactions

MNX_ID

MNXM116679

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

formula

C₂₂H₂₂O₁₁

charge

mass

462.11621

reference

hmdb:HMDB0039189

InChIKey

FISMJUPMCGKNNX-SREVYHEPSA-N

InChI

InChI=1S/C22H22O11/c23-10-15-18(28)19(29)20(32-16(26)7-6-11-4-2-1-3-5-11)22(31-15)33-21(30)12-8-13(24)17(27)14(25)9-12/h1-9,15,18-20,22-25,27-29H,10H2/b7-6-

SMILES

O=C(/C=C\c1ccccc1)OC1C(OC(=O)c2cc(O)c(O)c(O)c2)OC(CO)C(O)C1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
hmdb:HMDB0039189	2-Cinnamoyl-1-galloyl-beta-D-glucopyranose 2-Cinnamoyl-1-galloyl-b-D-glucopyranose 4,5-Dihydroxy-6-(hydroxymethyl)-3-{[(2Z)-3-phenylprop-2-enoyl]oxy}oxan-2-yl 3,4,5-trihydroxybenzoic acid 4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2Z)-3-phenylprop-2-enoyl]oxy}oxan-2-yl 3,4,5-trihydroxybenzoate
hmdb:HMDB39189	secondary/obsolete/fantasy identifier