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Chemical Entities of Biological Interest Ontology
Last uploaded:
December 1, 2024
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| Preferred Name | loracarbef | |
| Synonyms |
LORACABEF loracarbef loracarbefum (6R,7S)-7-{[(2R)-2-amino-2-phenylacetyl]amino}-3-chloro-8-oxo-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 7beta-[(2R)-2-amino-2-phenylacetyl]nitrilo-3-chloro-3,4-didehydrocepham-4-carboxylic acid |
|
| Definitions |
A synthetic "carba" analogue of cefaclor, with carbon replacing sulfur at position 1. Used to treat a wide range of infections caused by both gram-positive and gram-negative bacteria. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_47544 |
|
| charge |
0
|
|
| database_cross_reference |
PMID:1553350 CAS:76470-66-1 PMID:1621742 Patent:EP14476 PMID:1621740 LINCS:LSM-5429 PDBeChem:LOR HMDB:HMDB0014590 Reaxys:3631282 DrugBank:DB00447 KEGG:D08143 PMID:8453172 Patent:US4708956 Drug_Central:1603 PMID:9131470 PMID:29017833
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|
| definition |
A synthetic "carba" analogue of cefaclor, with carbon replacing sulfur at position 1. Used to treat a wide range of infections caused by both gram-positive and gram-negative bacteria.
|
|
| formula |
C16H16ClN3O4
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|
| has role | ||
| has_exact_synonym |
(6R,7S)-7-{[(2R)-2-amino-2-phenylacetyl]amino}-3-chloro-8-oxo-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 7beta-[(2R)-2-amino-2-phenylacetyl]nitrilo-3-chloro-3,4-didehydrocepham-4-carboxylic acid
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|
| has_obo_namespace |
chebi_ontology
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|
| has_related_synonym |
LORACABEF loracarbef loracarbefum
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|
| id |
CHEBI:47544
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|
| in_subset | ||
| inchi |
InChI=1S/C16H16ClN3O4/c17-9-6-7-10-12(15(22)20(10)13(9)16(23)24)19-14(21)11(18)8-4-2-1-3-5-8/h1-5,10-12H,6-7,18H2,(H,19,21)(H,23,24)/t10-,11-,12+/m1/s1
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|
| inchikey |
JAPHQRWPEGVNBT-UTUOFQBUSA-N
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| is conjugate acid of | ||
| is tautomer of | ||
| label |
loracarbef
|
|
| mass |
349.76900
|
|
| monoisotopicmass |
349.08293
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|
| notation |
CHEBI:47544
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|
| prefLabel |
loracarbef
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|
| smiles |
N[C@@H](C(=O)N[C@H]1[C@H]2CCC(Cl)=C(N2C1=O)C(O)=O)c1ccccc1
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| treeView | ||
| subClassOf |
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