CHEBI:19448 - 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid

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ChEBI Name 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid ChEBI ID CHEBI:19448 Definition An oxo dicarboxylic acid that is but-2-enedioic acid substituted by an amino group at position 2 and a 3-oxoprop-1-enyl group at position 3. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information No supplier information found for this compound. Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C7H7NO5 Net Charge 0 Average Mass 185.13422 Monoisotopic Mass 185.03242 InChI InChI=1S/C7H7NO5/c8-5(7(12)13)4(6(10)11)2-1-3-9/h1-3H,8H2,(H,10,11)(H,12,13) InChIKey KACPVQQHDVBVFC-UHFFFAOYSA-N SMILES [H]C(=O)C([H])=C([H])C(C(O)=O)=C(N)C(O)=O Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) Biological Role(s): human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). View more via ChEBI Ontology ChEBI Ontology Outgoing 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid (CHEBI:19448) has functional parent butenedioic acid (CHEBI:22958) 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid (CHEBI:19448) has role human metabolite (CHEBI:77746) 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid (CHEBI:19448) is a amino dicarboxylic acid (CHEBI:36164) 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid (CHEBI:19448) is a muconic semialdehyde (CHEBI:38436) 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid (CHEBI:19448) is a non-proteinogenic α-amino acid (CHEBI:83925) 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid (CHEBI:19448) is a oxo dicarboxylic acid (CHEBI:36145) 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid (CHEBI:19448) is conjugate acid of 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioate (CHEBI:29044) 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid (CHEBI:19448) is conjugate acid of 2-ammonio-3-(3-oxoprop-1-enyl)but-2-enedioate(1−) (CHEBI:77803) Incoming cis,cis-2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid (CHEBI:995) is a 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid (CHEBI:19448) 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioate (CHEBI:29044) is conjugate base of 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid (CHEBI:19448) 2-ammonio-3-(3-oxoprop-1-enyl)but-2-enedioate(1−) (CHEBI:77803) is conjugate base of 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid (CHEBI:19448) IUPAC Name 2-amino-3-(3-oxoprop-1-en-1-yl)but-2-enedioic acid Manual Xref Database HMDB0001330 HMDB View more database links Registry Number Type Source 1950054 Beilstein Registry Number Beilstein Last Modified 26 March 2015