CHEBI:41425 - (7R)-7-(4-carboxybutanamido)cephalosporanic acid

Main ChEBI Ontology Automatic Xrefs
ChEBI Name (7R)-7-(4-carboxybutanamido)cephalosporanic acid
ChEBI ID CHEBI:41425
ChEBI ASCII Name (7R)-7-(4-carboxybutanamido)cephalosporanic acid
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Save molfile Download Molfile
more structures >>
Formula C15H18N2O8S
Net Charge 0
Average Mass 386.37810
InChI InChI=1S/C15H18N2O8S/c1-7(18)25-5-8-6-26-14-11(13(22)17(14)12(8)15(23)24)16-9(19)3-2-4-10(20)21/h11,14H,2-6H2,1H3,(H,16,19)(H,20,21)(H,23,24)/t11-,14-/m1/s1
InChIKey IXUSDMGLUJZNFO-BXUZGUMPSA-N
SMILES [H][C@]12SCC(COC(C)=O)=C(N1C(=O)[C@H]2NC(=O)CCCC(O)=O)C(O)=O
Roles Classification
Biological Role(s): 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 (7R)-7-(4-carboxybutanamido)cephalosporanic acid (CHEBI:41425) has functional parent cephalosporanic acid (CHEBI:23064)
(7R)-7-(4-carboxybutanamido)cephalosporanic acid (CHEBI:41425) is a cephalosporin (CHEBI:23066)
(7R)-7-(4-carboxybutanamido)cephalosporanic acid (CHEBI:41425) is conjugate acid of (7R)-7-(4-carboxylatobutanamido)cephalosporanate (CHEBI:58693)
Incoming (7R)-7-(4-carboxylatobutanamido)cephalosporanate (CHEBI:58693) is conjugate base of (7R)-7-(4-carboxybutanamido)cephalosporanic acid (CHEBI:41425)
IUPAC Name
(6R,7R)-3-[(acetyloxy)methyl]-7-(4-carboxybutanamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Synonyms Sources
(7R)-7-(4-Carboxybutanamido)cephalosporanate KEGG COMPOUND
7-Glutarylaminocephalosporanate KEGG COMPOUND
7BETA-(4CARBOXYBUTANAMIDO) CEPHALOSPORANIC ACID PDBeChem
Gl-7-Aca ChemIDplus
Glutaryl-7-aca ChemIDplus
Glutaryl-7-aminocephalosporanic acid ChemIDplus
Database Links Databases
C15666 KEGG COMPOUND
CEN PDBeChem
View more database links
Registry Numbers Types Sources
1183847 Beilstein Registry Number Beilstein
27920-90-7 CAS Registry Number ChemIDplus
Last Modified
30 July 2010