CHEBI:51758 - azidocillin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name azidocillin
ChEBI ID CHEBI:51758
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C16H17N5O4S
Net Charge 0
Average Mass 375.40348
Monoisotopic Mass 375.10013
InChI InChI=1S/C16H17N5O4S/c1-16(2)11(15(24)25)21-13(23)10(14(21)26-16)18-12(22)9(19-20-17)8-6-4-3-5-7-8/h3-7,9-11,14H,1-2H3,(H,18,22)(H,24,25)/t9-,10-,11+,14-/m1/s1
InChIKey ODFHGIPNGIAMDK-NJBDSQKTSA-N
SMILES [H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)[C@H](N=[N+]=[N-])c1ccccc1)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): allergen
A chemical compound, or part thereof, which causes the onset of an allergic reaction by interacting with any of the molecular pathways involved in an allergy.
(via penicillin )
antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
(via heterocyclic antibiotic )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing azidocillin (CHEBI:51758) is a penicillin (CHEBI:17334)
azidocillin (CHEBI:51758) is conjugate acid of azidocillin(1−) (CHEBI:51762)
Incoming azidocillin(1−) (CHEBI:51762) is conjugate base of azidocillin (CHEBI:51758)
azidocilloyl group (CHEBI:58977) is substituent group from azidocillin (CHEBI:51758)
IUPAC Name
2,2-dimethyl-6β-[(2R)-2-azido-2-phenylacetamido]penam-3α-carboxylic acid
INNs Sources
azidocilina ChemIDplus
azidocilline ChemIDplus
Synonyms Sources
(2S,5R,6R)-6-{[(2R)-2-azido-2-phenylacetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC
azidocillin ChemIDplus
azidocillinum ChemIDplus
D-(−)-(α-azidobenzyl)penicillin ChemIDplus
Manual Xrefs Databases
273 DrugCentral
DB08795 DrugBank
GB940488 Patent
US3293242 Patent
View more database links
Registry Number Type Source
17243-38-8 CAS Registry Number ChemIDplus
Last Modified
22 February 2017