CHEBI:104123 - 5-propyl-4-(1-pyrrolidinylmethyl)-2-furancarboxylic acid

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ChEBI Name 5-propyl-4-(1-pyrrolidinylmethyl)-2-furancarboxylic acid
ChEBI ID CHEBI:104123
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C13H19NO3
Net Charge 0
Average Mass 237.295
Monoisotopic Mass 237.13649
InChI InChI=1S/C13H19NO3/c1-2-5-11-10(8-12(17-11)13(15)16)9-14-6-3-4-7-14/h8H,2-7,9H2,1H3,(H,15,16)
InChIKey BEVFYPNHCDGTJQ-UHFFFAOYSA-N
SMILES CCCC1=C(C=C(O1)C(=O)O)CN2CCCC2
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 5-propyl-4-(1-pyrrolidinylmethyl)-2-furancarboxylic acid (CHEBI:104123) is a furoic acid (CHEBI:36055)
Manual Xref Database
LSM-15480 LINCS
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