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Chemical Entities of Biological Interest Ontology
Last uploaded:
January 1, 2025
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| Preferred Name | propicillin potassium | |
| Synonyms |
potassium (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2-phenoxybutanoyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Brocillin potassium 6beta-(2-phenoxybutanamido)-2,2-dimethylpenam-3alpha-carboxylate Propicillin potassium |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_32062 |
|
| charge |
0
|
|
| database_cross_reference |
KEGG:C13110 CAS:1245-44-9 KEGG:D01649 Beilstein:5403812
|
|
| formula |
C18H21KN2O5S C18H21N2O5S.K
|
|
| has part | ||
| has_exact_synonym |
potassium 6beta-(2-phenoxybutanamido)-2,2-dimethylpenam-3alpha-carboxylate Propicillin potassium
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
potassium (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2-phenoxybutanoyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Brocillin
|
|
| id |
CHEBI:32062
|
|
| in_subset | ||
| inchi |
InChI=1S/C18H22N2O5S.K/c1-4-11(25-10-8-6-5-7-9-10)14(21)19-12-15(22)20-13(17(23)24)18(2,3)26-16(12)20;/h5-9,11-13,16H,4H2,1-3H3,(H,19,21)(H,23,24);/q;+1/p-1/t11?,12-,13+,16-;/m1./s1
|
|
| inchikey |
ULBKMFLWMIGVOJ-CFXUUZMDSA-M
|
|
| label |
propicillin potassium
|
|
| mass |
416.53300
|
|
| monoisotopicmass |
416.08082
|
|
| notation |
CHEBI:32062
|
|
| prefLabel |
propicillin potassium
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|
| smiles |
[K+].[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)C(CC)Oc1ccccc1)C([O-])=O
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| treeView | ||
| subClassOf |
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