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1-O-salicyl-beta-D-glucose

Properties

Image

Occurences in reactions

MNX_ID

MNXM21683

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

formula

C₁₃H₁₆O₈

charge

mass

300.08452

reference

InChIKey

XNHKMZHWRNMFCU-HMUNZLOLSA-N

InChI

InChI=1S/C13H16O8/c14-5-8-9(16)10(17)11(18)13(20-8)21-12(19)6-3-1-2-4-7(6)15/h1-4,8-11,13-18H,5H2/t8-,9-,10+,11-,13+/m1/s1

SMILES

O=C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:145681 chebi:145681	1-O-salicyl-beta-D-glucose 1-O-(2-hydroxybenzoyl)-beta-D-glucopyranose 1-O-(o-hydroxybenzoyl)-beta-D-glucopyranose beta-D-glucopyranosyl salicylate beta-D-glucosyl salicylate salicylate-beta-D-glucose ester salicylic acid acyl beta-D-glucoside salicylic acid beta-D-glucopyranosyl ester salicylic acid beta-D-glucose ester
seed.compound:cpd23501 seedM:cpd23501	2-hydroxybenzoic acid glucose ester SA beta-D-glucose ester SGE beta-D-glucopyranose, 1-(2-hydroxybenzoate) glucosyl salicylate salicylate beta-D-glucose ester salicylic acid beta-D-glucose ester
metacyc.compound:CPD-12629 metacycM:CPD-12629	salicylate beta-D-glucose ester 2-hydroxybenzoic acid glucose ester SA beta-D-glucose ester SGE beta-D-glucopyranose, 1-(2-hydroxybenzoate) glucosyl salicylate salicylic acid beta-D-glucose ester
seedM:M_cpd23501	secondary/obsolete/fantasy identifier