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beta-Glucopyranosyl anthranilate

PropertiesImage
MNX_IDMNXM16099 Image of MNXM16099
referencechebi:176467
formulaC13H17NO7
global charge0
mol weight299.279
InChIKeyGTQKOJVFDJDUGN-HMUNZLOLSA-N
InChIInChI=1S/C13H17NO7/c14-7-4-2-1-3-6(7)12(19)21-13-11(18)10(17)9(16)8(5-15)20-13/h1-4,8-11,13,15-18H,5,14H2/t8-,9-,10+,11-,13+/m1/s1
SMILESNC1=C(C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=CC=C1
MNX internals
InChI (mnx)InChI=1/C13H17NO7/c14-7-4-2-1-3-6(7)12(19)21-13-11(18)10(17)9(16)8(5-15)20-13/h1-4,8-11,13,15-18H,5,14H2/t8-,9-,10+,11-,13+/m1/s1 Image of MNXM16099
SMILES (mnx)[CH:1]1=[CH:2][CH:4]=[C:7]([NH2:14])[C:6]([C:12](=[O:19])[O:21][C@H:13]2[C@H:11]([OH:18])[C@@H:10]([OH:17])[C@H:9]([OH:16])[C@@H:8]([CH2:5][OH:15])[O:20]2)=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:176467
chebi:176467
GTQKOJVFDJDUGN-HMUNZLOLSA-N 		beta-Glucopyranosyl anthranilate
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 2-aminobenzoate

seed.compound:cpd23603
seedM:cpd23603
GTQKOJVFDJDUGN-HMUNZLOLSA-N 		1-O-beta-D-Glucopyranosyl anthranilate
2-aminobenzoic acid-beta-glucoside
D-Glucose 1-anthranilate
anthranilate-beta-glucoside
anthranilic acid, beta-D-glucosyl ester
anthranilic acid-beta-glucoside
anthraniloyl-O-glucopyranose
anthraniloyl-O-glucose

metacyc.compound:CPD-12835
metacycM:CPD-12835
GTQKOJVFDJDUGN-HMUNZLOLSA-N 		anthraniloyl-O-glucopyranose
1-O-beta-D-Glucopyranosyl anthranilate
2-aminobenzoic acid-beta-glucoside
D-Glucose 1-anthranilate
anthranilate-beta-glucoside
anthranilic acid, beta-D-glucosyl ester
anthranilic acid-beta-glucoside
anthraniloyl-O-glucose

seedM:M_cpd23603 		secondary/obsolete/fantasy identifier