CHEBI:88610 - N-Acetylcystathionine

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ChEBI Name N-Acetylcystathionine ChEBI ID CHEBI:88610 Stars This entity has been manually annotated by a third party. 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 C9H16N2O5S Net Charge 0 Average Mass 264.300 Monoisotopic Mass 264.07799 InChI InChI=1S/C9H16N2O5S/c1-5(12)11-7(9(15)16)4-17-3-2-6(10)8(13)14/h6-7H,2-4,10H2,1H3,(H,11,12)(H,13,14)(H,15,16)/t6-,7?/m0/s1 InChIKey QWACVTVBTRSCRL-PKPIPKONSA-N SMILES S(CC[C@H](N)C(O)=O)CC(NC(=O)C)C(O)=O Metabolite of Species Details Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: MetaGene: http://www.metagene.de/program/d.prg?mp=gamma-CYSTATHIONASE%20DEFICIENCY%20(CTH) Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing N-Acetylcystathionine (CHEBI:88610) is a N-acyl-amino acid (CHEBI:51569) Synonyms Sources (2S)-2-amino-4-[(2-carboxy-2-acetamidoethyl)sulfanyl]butanoic acid HMDB N-Monoacetylcystathionine HMDB Nac-cysta HMDB S-(2-(Acetylamino)-2-carboxyethyl)-L-Homocysteine HMDB S-(L-2-(Acetylamino)-2-carboxyethyl)-L-homocysteine HMDB Manual Xref Database HMDB0002381 HMDB View more database links Registry Number Type Source 20619-80-1 CAS Registry Number KEGG COMPOUND Citations Types Sources 1793738 PubMed citation Europe PMC 9437538 PubMed citation Europe PMC