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4-nitrophenyl beta-D-glucoside

PropertiesImage
MNX_IDMNXM731468 Image of MNXM731468
referencechebi:90259
formulaC12H15NO8
global charge0
mol weight301.251
InChIKeyIFBHRQDFSNCLOZ-RMPHRYRLSA-N
InChIInChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-3-1-6(2-4-7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
SMILESO=[N+]([O-])C1=CC=C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=C1
MNX internals
InChI (mnx)InChI=1/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-3-1-6(2-4-7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9-,10+,11-,12-/m1/s1 Image of MNXM731468
SMILES (mnx)[CH:1]1=[CH:3][C:7]([O:20][C@H:12]2[C@H:11]([OH:17])[C@@H:10]([OH:16])[C@H:9]([OH:15])[C@@H:8]([CH2:5][OH:14])[O:21]2)=[CH:4][CH:2]=[C:6]1[N+:13]([O-:18])=[O:19]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)8
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:90259
chebi:90259
IFBHRQDFSNCLOZ-RMPHRYRLSA-N 		4-nitrophenyl beta-D-glucoside
1-O-p-Nitrophenyl-D-glucose
4-Nitrophenyl beta-D-glucopyranoside
4-Nitrophenyl beta-D-glucoside
4-nitrophenyl beta-D-glucopyranoside
p-Nitrophenyl-beta-glucoside
p-nitrophenyl beta-D-glucoside
hmdb:HMDB0245678
IFBHRQDFSNCLOZ-UHFFFAOYSA-N 		4-Nitrophenyl beta-D-glucopyranoside
2-(hydroxymethyl)-6-(4-nitrophenoxy)oxane-3,4,5-triol
4-Nitrophenyl b-D-glucopyranoside

metacyc.compound:CPD-13211
metacycM:CPD-13211
seed.compound:cpd23777
seedM:cpd23777
IFBHRQDFSNCLOZ-RMPHRYRLSA-N 		4-nitrophenyl-beta-D-glucopyranoside
4-nitrophenyl-beta-D-glucoside
p-nitrophenyl-beta-D-glucopyranoside
p-nitrophenyl-beta-D-glucoside
pNPG
pNPbetaGlu

sabiork.compound:18851
sabiorkM:18851
IFBHRQDFSNCLOZ-UHFFFAOYSA-N 		p-Nitrophenol alpha-D-glucopyranoside
4-Nitrophenol alpha-D-glucopyranoside
para-Nitrophenol alpha-D-glucopyranoside

sabiork.compound:24765
sabiorkM:24765
IFBHRQDFSNCLOZ-UHFFFAOYSA-N 		p-Nitrophenyl-alpha-D-glucoside
4-Nitrophenyl-alpha-D-glucopyranoside
4-Nitrophenyl-alpha-D-glucoside
p-Nitrophenyl-alpha-D-glucopyranoside

sabiork.compound:24787
sabiorkM:24787
IFBHRQDFSNCLOZ-RMPHRYRLSA-N 		p-Nitrophenyl-beta-D-glucoside
4-Nitrophenyl beta-D-glucopyranoside

seedM:M_cpd23777 		secondary/obsolete/fantasy identifier