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1-O-(4-hydroxybenzoyl)-beta-D-glucose

PropertiesImage
MNX_IDMNXM146047 Image of MNXM146047
referencechebi:145301
formulaC13H16O8
global charge0
mol weight300.263
InChIKeyXWTGDGASXRARSP-HMUNZLOLSA-N
InChIInChI=1S/C13H16O8/c14-5-8-9(16)10(17)11(18)13(20-8)21-12(19)6-1-3-7(15)4-2-6/h1-4,8-11,13-18H,5H2/t8-,9-,10+,11-,13+/m1/s1
SMILESO=C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C1=CC=C(O)C=C1
MNX internals
InChI (mnx)InChI=1/C13H16O8/c14-5-8-9(16)10(17)11(18)13(20-8)21-12(19)6-1-3-7(15)4-2-6/h1-4,8-11,13-18H,5H2/t8-,9-,10+,11-,13+/m1/s1 Image of MNXM146047
SMILES (mnx)[CH:1]1=[CH:3][C:7]([OH:15])=[CH:4][CH:2]=[C:6]1[C:12](=[O:19])[O:21][C@H:13]1[C@H:11]([OH:18])[C@@H:10]([OH:17])[C@H:9]([OH:16])[C@@H:8]([CH2:5][OH:14])[O:20]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)18
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:145301
chebi:145301
XWTGDGASXRARSP-HMUNZLOLSA-N 		1-O-(4-hydroxybenzoyl)-beta-D-glucose
1-(4-hydroxybenzoyl)glucose
1-O-(4-hydroxybenzoyl)-beta-D-glucopyranose
1-O-4-hydroxybenzoyl-beta-D-glucose
1-O-p-hydroxybenzoyl-beta-D-glucose
4-hydroxybenzoic acid beta-D-glucopyranosyl ester
p-hydroxybenzoyl beta-D-glucopyranoside

sabiork.compound:30198
sabiorkM:30198
XWTGDGASXRARSP-HMUNZLOLSA-N 		1-O-4-Hydroxybenzoyl-beta-D-glucose

metacyc.compound:CPD-15283
metacycM:CPD-15283
seed.compound:cpd32975
seedM:cpd32975
XWTGDGASXRARSP-HMUNZLOLSA-N 		1-O-4-hydroxybenzoyl-beta-D-glucose
1-O-p-hydroxybenzoyl-beta-D-glucose
4-hydroxybenzoyl glucose
p-hydroxybenzoyl glucose
hmdb:HMDB0303022
XWTGDGASXRARSP-HMUNZLOLSA-N 		4-Hydroxybenzoyl glucose
(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 4-hydroxybenzoate
1-(4-Hydroxybenzoyl)glucose
1-O-(4-Hydroxybenzoyl)-b-D-glucopyranose
1-O-(4-Hydroxybenzoyl)-beta-D-glucopyranose
1-O-4-Hydroxybenzoyl-b-D-glucose
1-O-4-Hydroxybenzoyl-beta-D-glucose
1-O-P-Hydroxybenzoyl-beta-D-glucose
1-O-p-Hydroxybenzoyl-b-D-glucose
1-O-p-Hydroxybenzoyl-beta-D-glucose
4-Hydroxybenzoate b-D-glucopyranosyl ester
4-Hydroxybenzoate beta-D-glucopyranosyl ester
4-Hydroxybenzoic acid b-D-glucopyranosyl ester
4-Hydroxybenzoic acid beta-D-glucopyranosyl ester
P-Hydroxybenzoyl glucose
p-Hydroxybenzoyl b-D-glucopyranoside
p-Hydroxybenzoyl beta-D-glucopyranoside

seedM:M_cpd32975 		secondary/obsolete/fantasy identifier