CHEBI:16083 - (S)-3-(indol-3-yl)-2-oxobutyric acid

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ChEBI Name (S)-3-(indol-3-yl)-2-oxobutyric acid ChEBI ID CHEBI:16083 ChEBI ASCII Name (S)-3-(indol-3-yl)-2-oxobutyric acid Definition The (S)-enantiomer of 3-(indol-3-yl)-2-oxobutyric acid. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:18771, CHEBI:443, CHEBI:12415, CHEBI:18772 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 C12H11NO3 Net Charge 0 Average Mass 217.22068 Monoisotopic Mass 217.07389 InChI InChI=1S/C12H11NO3/c1-7(11(14)12(15)16)9-6-13-10-5-3-2-4-8(9)10/h2-7,13H,1H3,(H,15,16)/t7-/m0/s1 InChIKey VSANSNPZLCXLRK-ZETCQYMHSA-N SMILES C[C@H](C(=O)C(O)=O)c1c[nH]c2ccccc12 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 (S)-3-(indol-3-yl)-2-oxobutyric acid (CHEBI:16083) is a 3-(indol-3-yl)-2-oxobutyric acid (CHEBI:28549) (S)-3-(indol-3-yl)-2-oxobutyric acid (CHEBI:16083) is conjugate acid of (S)-3-(indol-3-yl)-2-oxobutyrate (CHEBI:57633) (S)-3-(indol-3-yl)-2-oxobutyric acid (CHEBI:16083) is enantiomer of (R)-3-(indol-3-yl)-2-oxobutyric acid (CHEBI:112106) Incoming (S)-3-(indol-3-yl)-2-oxobutyrate (CHEBI:57633) is conjugate base of (S)-3-(indol-3-yl)-2-oxobutyric acid (CHEBI:16083) (R)-3-(indol-3-yl)-2-oxobutyric acid (CHEBI:112106) is enantiomer of (S)-3-(indol-3-yl)-2-oxobutyric acid (CHEBI:16083) IUPAC Name (3S)-3-(1H-indol-3-yl)-2-oxobutanoic acid Synonyms Sources (S)-beta-Methylindolepyruvate KEGG COMPOUND (S)-β-methylindolepyruvic acid ChEBI Registry Number Type Source 477499 Beilstein Registry Number Beilstein Last Modified 28 May 2024