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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:3478 - cefaclor
Main
ChEBI Ontology
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ChEBI Name
cefaclor
ChEBI ID
CHEBI:3478
Definition
A cephalosporin bearing chloro and (
R
)-2-amino-2-phenylacetamido groups at positions 3 and 7, respectively, of the cephem skeleton.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:472656
Supplier Information
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Molfile
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Wikipedia
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Read full article at Wikipedia
Formula
C15H14ClN3O4S
Net Charge
0
Average Mass
367.80700
Monoisotopic Mass
367.03935
InChI
InChI=1S/C15H14ClN3O4S/c16-
8-
6-
24-
14-
10(13(21)
19(14)
11(8)
15(22)
23)
18-
12(20)
9(17)
7-
4-
2-
1-
3-
5-
7/h1-
5,9-
10,14H,6,17H2,(H,18,20)
(H,22,23)
/t9-
,10-
,14-
/m1/s1
InChIKey
QYIYFLOTGYLRGG-GPCCPHFNSA-N
SMILES
[H][C@]12SCC(Cl)=C(N1C(=O)[C@H]2NC(=O)[C@H](N)c1ccccc1)C(O)=O
Roles Classification
Biological Role
(s):
antibacterial drug
A drug used to treat or prevent bacterial infections.
drug allergen
Any drug which causes the onset of an allergic reaction.
(via
cephalosporin
)
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.
drug allergen
Any drug which causes the onset of an allergic reaction.
(via
cephalosporin
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
cefaclor (
CHEBI:3478
)
has role
antibacterial drug (
CHEBI:36047
)
cefaclor (
CHEBI:3478
)
has role
drug allergen (
CHEBI:88188
)
cefaclor (
CHEBI:3478
)
is a
cephalosporin (
CHEBI:23066
)
IUPAC Names
(6
R
,7
R
)-
7-
{[(2
R
)-
2-
amino-
2-
phenylacetyl]amino}-
3-
chloro-
8-
oxo-
5-
thia-
1-
azabicyclo[4.2.0]oct-
2-
ene-
2-
carboxylic acid
7β-{[(2
R
)-2-amino-2-phenylacetyl]amino}-3-chloro-3,4-didehydrocepham-4-carboxylic acid
INN
Source
cefaclorum
DrugBank
Synonyms
Sources
3-Chloro-7-D-(2-phenylglycinamido)-3-cephem-4-carboxylic acid
ChemIDplus
CCL
KEGG DRUG
cefaclor
ChEMBL
Cefaclor
KEGG COMPOUND
Cefaclor anhydrous
ChemIDplus
Cephaclor
ChemIDplus
Manual Xrefs
Databases
525
DrugCentral
C06877
KEGG COMPOUND
Cefaclor
Wikipedia
D00256
KEGG DRUG
DB00833
DrugBank
DE2408698
Patent
HMDB0014971
HMDB
LSM-5368
LINCS
US3925372
Patent
View more database links
Registry Numbers
Types
Sources
3632473
Reaxys Registry Number
Reaxys
53994-73-3
CAS Registry Number
ChemIDplus
53994-73-3
CAS Registry Number
KEGG DRUG
53994-73-3
CAS Registry Number
DrugBank
Citations
Types
Sources
10230635
PubMed citation
ChEMBL
10930630
PubMed citation
Europe PMC
11963587
PubMed citation
Europe PMC
12485718
PubMed citation
Europe PMC
12569987
PubMed citation
Europe PMC
15812119
PubMed citation
Europe PMC
18969055
PubMed citation
Europe PMC
29017833
PubMed citation
Europe PMC
Last Modified
09 February 2018