CHEBI:113247 - 4-(4-ethyl-1-piperazinyl)-4-oxo-2-butenoic acid

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ChEBI Name 4-(4-ethyl-1-piperazinyl)-4-oxo-2-butenoic acid
ChEBI ID CHEBI:113247
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C10H16N2O3
Net Charge 0
Average Mass 212.246
Monoisotopic Mass 212.11609
InChI InChI=1S/C10H16N2O3/c1-2-11-5-7-12(8-6-11)9(13)3-4-10(14)15/h3-4H,2,5-8H2,1H3,(H,14,15)
InChIKey RZWNXLICCRVKFW-UHFFFAOYSA-N
SMILES CCN1CCN(CC1)C(=O)C=CC(=O)O
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 4-(4-ethyl-1-piperazinyl)-4-oxo-2-butenoic acid (CHEBI:113247) is a heterocyclic fatty acid (CHEBI:48847)
Manual Xref Database
LSM-24658 LINCS
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