CHEBI:82725 - ovothiol C zwitterion

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name ovothiol C zwitterion ChEBI ID CHEBI:82725 Definition An L-α-amino acid zwitterion formed from ovothiol C by transfer of a proton from the carboxy to the amino group; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter Kristian Axelsen 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 C9H15N3O2S Net Charge 0 Average Mass 229.29900 Monoisotopic Mass 229.08850 InChI InChI=1S/C9H15N3O2S/c1-11(2)7(9(13)14)4-6-8(15)10-5-12(6)3/h5,7,15H,4H2,1-3H3,(H,13,14)/t7-/m0/s1 InChIKey ONAWDGXCZMVYMN-ZETCQYMHSA-N SMILES C[NH+](C)[C@@H](Cc1c(S)ncn1C)C([O-])=O ChEBI Ontology Outgoing ovothiol C zwitterion (CHEBI:82725) has functional parent L-histidine zwitterion (CHEBI:57595) ovothiol C zwitterion (CHEBI:82725) is a L-α-amino acid zwitterion (CHEBI:59869) ovothiol C zwitterion (CHEBI:82725) is tautomer of ovothiol C (CHEBI:83415) Incoming ovothiol C (CHEBI:83415) is tautomer of ovothiol C zwitterion (CHEBI:82725) IUPAC Name (2S)-2-(dimethylazaniumyl)-3-(1-methyl-4-sulfanyl-1H-imidazol-5-yl)propanoate Citations Types Sources 21247153 PubMed citation SUBMITTER 8033907 PubMed citation SUBMITTER Last Modified 24 October 2014