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CHEBI:131919 - nocardicin G zwitterion

ChEBI IDCHEBI:131919
ChEBI Namenocardicin G zwitterion
Stars
DefinitionAn amino acid zwitterion resulting from a transfer of a proton from the carboxy group to the amino group of nocardicin G; major species at pH 7.3.
Last Modified17 June 2016
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC19H19N3O6
Net Charge0
Average Mass385.376
Monoisotopic Mass385.12739
SMILES[NH3+][C@@H](C(=O)N[C@H]1CN([C@@H](C(=O)[O-])c2ccc(O)cc2)C1=O)c1ccc(O)cc1
InChIInChI=1S/C19H19N3O6/c20-15(10-1-5-12(23)6-2-10)17(25)21-14-9-22(18(14)26)16(19(27)28)11-3-7-13(24)8-4-11/h1-8,14-16,23-24H,9,20H2,(H,21,25)(H,27,28)/t14-,15+,16+/m0/s1
InChIKeySAVAPYNOQXYBJS-ARFHVFGLSA-N
ChEBI Ontology
Outgoing Relation(s)
nocardicin G zwitterion (CHEBI:131919) is a amino-acid zwitterion (CHEBI:35238)
nocardicin G zwitterion (CHEBI:131919) is tautomer of nocardicin G (CHEBI:81024)
Incoming Relation(s)
nocardicin G (CHEBI:81024) is tautomer of nocardicin G zwitterion (CHEBI:131919)
IUPAC Name 
(2R)-[(3S)-3-{[(2R)-2-azaniumyl-2-(4-hydroxyphenyl)acetyl]amino}-2-oxoazetidin-1-yl](4-hydroxyphenyl)acetate
UniProt Name  Source
nocardicin GUniProt
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