CHEBI:87766 - 2-(D-glucosyloxy)benzoic acid

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ChEBI Name 2-(D-glucosyloxy)benzoic acid ChEBI ID CHEBI:87766 ChEBI ASCII Name 2-(D-glucosyloxy)benzoic acid Definition A monosaccharide derivative that is salicylic acid in which the phenolic hydrogen is replaced by a D-glucosyl residue. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C13H16O8 Net Charge 0 Average Mass 300.262 Monoisotopic Mass 300.08452 InChI InChI=1S/C13H16O8/c14-5-8-9(15)10(16)11(17)13(21-8)20-7-4-2-1-3-6(7)12(18)19/h1-4,8-11,13-17H,5H2,(H,18,19)/t8-,9-,10+,11-,13?/m1/s1 InChIKey TZPBMNKOLMSJPF-TWEVDUBQSA-N SMILES O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)C1OC=2C(=CC=CC2)C(O)=O)CO Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing 2-(D-glucosyloxy)benzoic acid (CHEBI:87766) has functional parent salicylic acid (CHEBI:16914) 2-(D-glucosyloxy)benzoic acid (CHEBI:87766) is a D-glucoside (CHEBI:35436) 2-(D-glucosyloxy)benzoic acid (CHEBI:87766) is a benzoic acids (CHEBI:22723) 2-(D-glucosyloxy)benzoic acid (CHEBI:87766) is a monosaccharide derivative (CHEBI:63367) Incoming 2-(β-D-glucopyranosyloxy)benzoic acid (CHEBI:145663) is a 2-(D-glucosyloxy)benzoic acid (CHEBI:87766) IUPAC Names 2-(D-glucopyranosyloxy)benzoic acid 2-{[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}benzoic acid Synonyms Sources 2-(D-glucopyranosyloxy)benzoic acid ChEBI O-glucosylsalicylic acid ChEBI salicylic acid glucopyranoside ChEBI salicylic acid glucoside ChEBI Registry Numbers Types Sources 10366-91-3 CAS Registry Number ChemIDplus 27062329 Reaxys Registry Number Reaxys Last Modified 11 December 2019