CHEBI:195433 - BFNB

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ChEBI Name BFNB
ChEBI ID CHEBI:195433
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C15H19NO5
Net Charge 0
Average Mass 293.319
Monoisotopic Mass 293.12632
InChI InChI=1S/C15H19NO5/c1-15(2)9-10-5-3-6-11(13(10)21-15)20-14(19)16-8-4-7-12(17)18/h3,5-6H,4,7-9H2,1-2H3,(H,16,19)(H,17,18)
InChIKey KRLRNENWNQPSPG-UHFFFAOYSA-N
SMILES CC1(C)CC2=CC=CC(OC(=O)NCCCC(O)=O)=C2O1
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): hapten
Any substance capable of eliciting an immune response only when attached to a large carrier such as a protein. Examples include dinitrophenols; oligosaccharides; peptides; and heavy metals.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing BFNB (CHEBI:195433) has role hapten (CHEBI:59174)
BFNB (CHEBI:195433) is a 1-benzofurans (CHEBI:38830)
BFNB (CHEBI:195433) is a carbamate ester (CHEBI:23003)
BFNB (CHEBI:195433) is a monocarboxylic acid (CHEBI:25384)
IUPAC Name
4-({[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]carbonyl}amino)butanoic acid
Synonym Source
4-[[(2,3-dihydro-2,2-dimethyl-7-benzofuranyloxy)carbonyl]-amino]butanoic acid ChEBI
Manual Xref Database
67162249 ChemSpider
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Citation Waiting for Citations Type Source
10794653 PubMed citation Europe PMC
Last Modified
19 July 2023