CHEBI:17711 - nocardicin A

ChEBI IDCHEBI:17711
ChEBI Namenocardicin A
Stars
Secondary ChEBI IDsCHEBI:7604, CHEBI:14662, CHEBI:25570
Last Modified18 December 2014
DownloadsMolfile
FormulaC23H24N4O9
Net Charge0
Average Mass500.464
Monoisotopic Mass500.15433
SMILESN[C@H](CCOc1ccc(/C(=N/O)C(=O)N[C@H]2CN([C@@H](C(=O)O)c3ccc(O)cc3)C2=O)cc1)C(=O)O
InChIInChI=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)/b26-18-/t16-,17+,19-/m1/s1
InChIKeyCTNZOGJNVIFEBA-UPSUJEDGSA-N
Roles Classification
Chemical Roles:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
ChEBI Ontology
Outgoing Relation(s)
nocardicin A (CHEBI:17711) is a D-serine derivative (CHEBI:84133)
nocardicin A (CHEBI:17711) is a D-α-amino acid (CHEBI:16733)
nocardicin A (CHEBI:17711) is a dicarboxylic acid (CHEBI:35692)
nocardicin A (CHEBI:17711) is a nocardicin (CHEBI:25572)
nocardicin A (CHEBI:17711) is conjugate acid of nocardicin A(1−) (CHEBI:58244)
nocardicin A (CHEBI:17711) is conjugate acid of nocardicin A(2−) (CHEBI:77658)
Incoming Relation(s)
nocardicin A(1−) (CHEBI:58244) is conjugate base of nocardicin A (CHEBI:17711)
nocardicin A(2−) (CHEBI:77658) is conjugate base of nocardicin A (CHEBI:17711)
IUPAC Name 
O-{4-[(1Z)-2-{(3S)-1-[(R)-carboxy(4-hydroxyphenyl)methyl]-2-oxoazetidin-3-ylamino}-N-hydroxy-2-oxoethanimidoyl]phenyl}-D-homoserine
Synonym  Source
Nocardicin AKEGG COMPOUND
Manual XrefsDatabases
C01941KEGG COMPOUND
C01941KEGG COMPOUND
C00018088KNApSAcK
Registry NumbersSources
CAS:39391-39-4KEGG COMPOUND