CHEBI:17475 - aminomalonic acid

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ChEBI Name aminomalonic acid ChEBI ID CHEBI:17475 Definition An amino dicarboxylic acid that is malonic acid in which one of the methylene hydrogens has been replaced by an amino group. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:2656, CHEBI:42453, CHEBI:13770, CHEBI:22513 Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C3H5NO4 Net Charge 0 Average Mass 119.07614 Monoisotopic Mass 119.02186 InChI InChI=1S/C3H5NO4/c4-1(2(5)6)3(7)8/h1H,4H2,(H,5,6)(H,7,8) InChIKey JINBYESILADKFW-UHFFFAOYSA-N SMILES NC(C(O)=O)C(O)=O Metabolite of Species Details Daphnia magna (NCBI:txid35525) See: Mixtures of similarly acting compounds in Daphnia magna: From gene to metabolite and beyondTine Vandenbrouck, Oliver A.H. Jones, Nathalie Dom, Julian L. Griffin, Wim De CoenEnvironment International 36 (2010) 254-268 Homo sapiens (NCBI:txid9606) See: PubMed 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). Daphnia magna metabolite A Daphnia metabolite produced by the species Daphnia magna. View more via ChEBI Ontology ChEBI Ontology Outgoing aminomalonic acid (CHEBI:17475) has functional parent malonic acid (CHEBI:30794) aminomalonic acid (CHEBI:17475) has role Daphnia magna metabolite (CHEBI:83056) aminomalonic acid (CHEBI:17475) has role human metabolite (CHEBI:77746) aminomalonic acid (CHEBI:17475) is a amino dicarboxylic acid (CHEBI:36164) aminomalonic acid (CHEBI:17475) is conjugate acid of aminomalonate(1−) (CHEBI:58158) Incoming aminomalonate(1−) (CHEBI:58158) is conjugate base of aminomalonic acid (CHEBI:17475) IUPAC Name aminopropanedioic acid Synonyms Sources 2-Aminomalonic acid KEGG COMPOUND Aminomalonate KEGG COMPOUND Aminomalonic acid KEGG COMPOUND Manual Xrefs Databases AMINOMALONATE MetaCyc C00872 KEGG COMPOUND DB02289 DrugBank ECMDB21430 ECMDB FGL PDBeChem HMDB0001147 HMDB View more database links Registry Numbers Types Sources 1068-84-4 CAS Registry Number ChemIDplus 1704564 Reaxys Registry Number Reaxys Citations Types Sources 1621954 PubMed citation Europe PMC 20117838 PubMed citation Europe PMC Last Modified 23 October 2015