CHEBI:560555 - cefditoren pivoxil

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name cefditoren pivoxil
ChEBI ID CHEBI:560555
Definition The pivaloyloxymethyl ester prodrug of cefditoren.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:606444, CHEBI:31367
Supplier Information
Download Molfile XML SDF
more structures >>
Wikipedia License
Waiting for wikipedia content
Read full article at Wikipedia
Formula C25H28N6O7S3
Net Charge 0
Average Mass 620.72100
Monoisotopic Mass 620.118
InChI InChI=1S/C25H28N6O7S3/c1-12-15(41-10-27-12)7-6-13-8-39-21-17(29-19(32)16(30-36-5)14-9-40-24(26)28-14)20(33)31(21)18(13)22(34)37-11-38-23(35)25(2,3)4/h6-7,9-10,17,21H,8,11H2,1-5H3,(H2,26,28)(H,29,32)/b7-6-,30-16-/t17-,21-/m1/s1
InChIKey AFZFFLVORLEPPO-UVYJNCLZSA-N
SMILES [H][C@]12SCC(\C=C/c3scnc3C)=C(N1C(=O)[C@H]2NC(=O)C(=N/OC)\c1csc(N)n1)C(=O)OCOC(=O)C(C)(C)C
Roles Classification
Biological Role(s): antibacterial drug
A drug used to treat or prevent bacterial infections.
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.
prodrug
A compound that, on administration, must undergo chemical conversion by metabolic processes before becoming the pharmacologically active drug for which it is a prodrug.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing cefditoren pivoxil (CHEBI:560555) has functional parent cefditoren (CHEBI:59343)
cefditoren pivoxil (CHEBI:560555) has role antibacterial drug (CHEBI:36047)
cefditoren pivoxil (CHEBI:560555) has role prodrug (CHEBI:50266)
cefditoren pivoxil (CHEBI:560555) is a 1,3-thiazoles (CHEBI:38418)
cefditoren pivoxil (CHEBI:560555) is a cephams (CHEBI:35995)
cefditoren pivoxil (CHEBI:560555) is a oxime O-ether (CHEBI:36816)
cefditoren pivoxil (CHEBI:560555) is a pivaloyloxymethyl ester (CHEBI:136685)
IUPAC Names
[(2,2-dimethylpropanoyl)oxy]methyl (6R,7R)-7-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-3-[(Z)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
[(2,2-dimethylpropanoyl)oxy]methyl 7β-(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetamido-3-[(Z)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]-3,4-didehydrocepham-4-carboxylic acid
Synonyms Sources
cefditoren pivaloyloxymethyl ester ChemIDplus
Cefditoren pivoxil KEGG COMPOUND
pivaloyloxymethyl (+)-(6R,7R)-7-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-3-[(Z)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate ChEBI
Manual Xrefs Databases
534 DrugCentral
Cefditoren_Pivoxil Wikipedia
D01628 KEGG DRUG
DB01066 DrugBank
View more database links
Registry Numbers Types Sources
117467-28-4 CAS Registry Number ChemIDplus
117467-28-4 CAS Registry Number KEGG DRUG
4902739 Beilstein Registry Number Beilstein
Last Modified
31 March 2017