1-O-(4-aminobenzoyl)-beta-D-glucopyranose (CHEBI:139329)

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CHEBI:139329 - 1-O-(4-aminobenzoyl)-β-D-glucopyranose

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ChEBI ID	CHEBI:139329
ChEBI Name	1-O-(4-aminobenzoyl)-β-D-glucopyranose
Stars
ASCII Name	1-O-(4-aminobenzoyl)-beta-D-glucopyranose
Definition	A β-D-glucoside that is β-D-glucopyranose in which the hydroxy group at position 1R is substituted by a (4-aminobenzoyl)oxy group.
Last Modified	4 August 2025
Submitter	mwilliams
Downloads	Molfile

Formula	C13H17NO7
Net Charge	0
Average Mass	299.279
Monoisotopic Mass	299.10050
SMILES	Nc1ccc(C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
InChI	InChI=1S/C13H17NO7/c14-7-3-1-6(2-4-7)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
InChIKey	DZWLQKNUQNGEPR-HMUNZLOLSA-N

Species of Metabolite	Component	Source	Comments
Eucalyptus perriniana (ncbitaxon:183845)	cell suspension culture (BTO:0000221)	DOI (10.1016/S0031-9422(97)01016-9)

Roles Classification

Chemical Role:	Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:	plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

ChEBI Ontology

Outgoing Relation(s)
	1-O-(4-aminobenzoyl)-β-D-glucopyranose (CHEBI:139329) has functional parent 4-aminobenzoic acid (CHEBI:30753)
	1-O-(4-aminobenzoyl)-β-D-glucopyranose (CHEBI:139329) has role plant metabolite (CHEBI:76924)
	1-O-(4-aminobenzoyl)-β-D-glucopyranose (CHEBI:139329) is a benzoate ester (CHEBI:36054)
	1-O-(4-aminobenzoyl)-β-D-glucopyranose (CHEBI:139329) is a substituted aniline (CHEBI:48975)
	1-O-(4-aminobenzoyl)-β-D-glucopyranose (CHEBI:139329) is a β-D-glucoside (CHEBI:22798)

IUPAC Name
1-O-(4-aminobenzoyl)-β-D-glucopyranose

Synonyms	Source
p-aminobenzoate-β-D-glucopyranosyl ester	ChEBI
(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl 4-aminobenzoate	IUPAC
4-aminobenzoyl β-D-glucopyranoside	ChEBI
4-aminobenzoyl-β-D-glucoside	ChEBI
p-aminobenzoic acid β-D-glucopyranosyl ester	ChEBI
p-aminobenzoyl β-D-glucopyranoside	ChEBI

UniProt Name	Source
1-O-(4-aminobenzoyl)-β-D-glucose	UniProt

Manual Xrefs	Databases
CPD-5804	MetaCyc

Citations