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o-Nitrophenyl-alpha-D-glucopyranoside

PropertiesImage
MNX_IDMNXM168732 Image of MNXM168732
referencesabiorkM:23097
formulaC12H15NO8
global charge0
mol weight301.251
InChIKeyKUWPCJHYPSUOFW-ZIQFBCGOSA-N
InChIInChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-4-2-1-3-6(7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9-,10+,11-,12+/m1/s1
SMILESO=[N+]([O-])C1=CC=CC=C1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
MNX internals
InChI (mnx)InChI=1/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-4-2-1-3-6(7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9-,10+,11-,12+/m1/s1 Image of MNXM168732
SMILES (mnx)[CH:1]1=[CH:2][CH:4]=[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)[C:6]([N+:13]([O-:18])=[O:19])=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

sabiork.compound:23097
sabiorkM:23097
KUWPCJHYPSUOFW-ZIQFBCGOSA-N
o-Nitrophenyl-alpha-D-glucopyranoside
2-Nitrophenyl-alpha-D-glucopyranoside