CHEBI:134869 - thurfyl nicotinate

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ChEBI Name thurfyl nicotinate
ChEBI ID CHEBI:134869
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C11H13NO3
Net Charge 0
Average Mass 207.226
Monoisotopic Mass 207.08954
InChI InChI=1S/C11H13NO3/c13-11(9-3-1-5-12-7-9)15-8-10-4-2-6-14-10/h1,3,5,7,10H,2,4,6,8H2
InChIKey RQAITHJHUFFEIV-UHFFFAOYSA-N
SMILES C(OCC1CCCO1)(=O)C=2C=CC=NC2
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing thurfyl nicotinate (CHEBI:134869) is a aromatic carboxylic acid (CHEBI:33859)
thurfyl nicotinate (CHEBI:134869) is a pyridines (CHEBI:26421)
Synonyms Sources
nicotafuryl DrugCentral
nicotinic acid tetrahydrofurfuryl ester DrugCentral
tetrahydrofurfuryl nicotinate DrugCentral
thurfyl nicotinat DrugCentral
trafuril DrugCentral
Manual Xref Database
3602 DrugCentral
View more database links
Registry Number Type Source
70-19-9 CAS Registry Number DrugCentral
Last Modified
23 February 2017