CHEBI:58244 - nocardicin A(1−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name nocardicin A(1−)
ChEBI ID CHEBI:58244
ChEBI ASCII Name nocardicin A(1-)
Definition An α-amino-acid anion that is the conjugate base of nocardicin A, arising from deprotonation of the carboxy groups and protonation of the amino group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C23H23N4O9
Net Charge -1
Average Mass 499.45010
Monoisotopic Mass 499.14705
InChI InChI=1S/C23H24N4O9/c24-16(22(31)32)9-10-36-15-7-3-12(4-8-15)18(26-35)20(29)25-17-11-27(21(17)30)19(23(33)34)13-1-5-14(28)6-2-13/h1-8,16-17,19,28,35H,9-11,24H2,(H,25,29)(H,31,32)(H,33,34)/p-1/b26-18-/t16-,17+,19-/m1/s1
InChIKey CTNZOGJNVIFEBA-UPSUJEDGSA-M
SMILES [NH3+][C@H](CCOc1ccc(cc1)C(=N\O)\C(=O)N[C@H]1CN([C@@H](C([O-])=O)c2ccc(O)cc2)C1=O)C([O-])=O
ChEBI Ontology
Outgoing nocardicin A(1−) (CHEBI:58244) is a α-amino-acid anion (CHEBI:33558)
nocardicin A(1−) (CHEBI:58244) is conjugate acid of nocardicin A(2−) (CHEBI:77658)
nocardicin A(1−) (CHEBI:58244) is conjugate base of nocardicin A (CHEBI:17711)
Incoming nocardicin A (CHEBI:17711) is conjugate acid of nocardicin A(1−) (CHEBI:58244)
nocardicin A(2−) (CHEBI:77658) is conjugate base of nocardicin A(1−) (CHEBI:58244)
IUPAC Name
(2R)-2-azaniumyl-4-{4-[(1Z)-2-({(3S)-1-[(R)-carboxylato(4-hydroxyphenyl)methyl]-2-oxoazetidin-3-yl}amino)-N-hydroxy-2-oxoethanimidoyl]phenoxy}butanoate
Synonym Source
nocardicin A anion ChEBI
Last Modified
17 April 2014