CHEBI:31444 - cyclacillin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name cyclacillin
ChEBI ID CHEBI:31444
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C15H23N3O4S
Net Charge 0
Average Mass 341.42694
Monoisotopic Mass 341.14093
InChI InChI=1S/C15H23N3O4S/c1-14(2)9(12(20)21)18-10(19)8(11(18)23-14)17-13(22)15(16)6-4-3-5-7-15/h8-9,11H,3-7,16H2,1-2H3,(H,17,22)(H,20,21)/t8-,9+,11-/m1/s1
InChIKey HGBLNBBNRORJKI-WCABBAIRSA-N
SMILES [H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)C1(N)CCCCC1)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): antibacterial drug
A drug used to treat or prevent bacterial infections.
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 )
Application(s): antibacterial drug
A drug used to treat or prevent bacterial infections.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing cyclacillin (CHEBI:31444) has role antibacterial drug (CHEBI:36047)
cyclacillin (CHEBI:31444) is a penicillin (CHEBI:17334)
IUPAC Name
6β-(1-aminocyclohexanecarboxamido)-2,2-dimethylpenam-3α-carboxylic acid
INNs Sources
ciclacilina ChemIDplus
ciclacillin KEGG DRUG
ciclacilline ChemIDplus
ciclacillinum ChemIDplus
Synonyms Sources
(1-aminocyclohexyl)penicillin ChemIDplus
(2S,5R,6R)-6-{[(1-aminocyclohexyl)carbonyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC
6-(1-aminocyclohexanecarboxamido)penicillanic acid ChemIDplus
6-(1-aminocyclohexylcarboxamido)penicillanic acid ChemIDplus
Cyclacillin KEGG COMPOUND
Brand Names Sources
Bastcillin DrugBank
Calthor DrugBank
Citosarin DrugBank
Cyclapen DrugBank
Cyclapen-W KEGG DRUG
Syngacillin DrugBank
Ultracillin DrugBank
Vastcillin KEGG DRUG
Vipicil DrugBank
Wyvital DrugBank
Manual Xrefs Databases
632 DrugCentral
C12766 KEGG COMPOUND
D01334 KEGG DRUG
DB01000 DrugBank
DE1800698 Patent
LSM-3987 LINCS
US3194802 Patent
US3478018 Patent
View more database links
Registry Numbers Types Sources
3485-14-1 CAS Registry Number KEGG COMPOUND
3485-14-1 CAS Registry Number ChemIDplus
849154 Beilstein Registry Number Beilstein
Last Modified
22 February 2017