loading...| Preferred Name |
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|
| Synonyms |
Benzylpenicillin 2,2-dimethyl-6beta-(phenylacetamido)penam-3alpha-carboxylic acid bencilpenicilina benzylpenicilline Penicillin G benzyl benicillin PENICILLIN G free penicillin II (2S,5R,6R)-3,3-dimethyl-7-oxo-6-(phenylacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid benzylpenicillin 6-(2-phenylacetamido)penicillanic acid benzylpenicillinic acid benzylpenicillinum PG PCG bensylpenicillin |
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| Definitions |
A penicillin in which the substituent at position 6 of the penam ring is a phenylacetamido group. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_18208 |
|
| charge |
0 |
|
| database_cross_reference |
CAS:61-33-6 Wikipedia:Benzylpenicillin Patent:US3024169 LINCS:LSM-3229 PDBeChem:PNN Beilstein:44740 Gmelin:781913 PMID:27731424 Reaxys:44740 PMID:7602118 KEGG:C05551 PMID:1384868 DrugBank:DB01053 PMID:12850488 PMID:16033609 PMID:11906332 PMID:1709917 PMID:24485692 PMID:25998949 KEGG:D02336 PMID:10930630 PMID:11431418 PMID:2083978 HMDB:HMDB0015186 PMID:12569987 PMID:29017833 PMID:6161899 PMID:7716788 Drug_Central:2082 PMID:24631718 PMID:29355985 |
|
| definition |
A penicillin in which the substituent at position 6 of the penam ring is a phenylacetamido group. |
|
| formula |
C16H18N2O4S |
|
| has_alternative_id |
CHEBI:7962 CHEBI:25866 CHEBI:45073 CHEBI:14743 |
|
| has_exact_synonym |
Benzylpenicillin 2,2-dimethyl-6beta-(phenylacetamido)penam-3alpha-carboxylic acid |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
bencilpenicilina benzylpenicilline Penicillin G benzyl benicillin PENICILLIN G free penicillin II (2S,5R,6R)-3,3-dimethyl-7-oxo-6-(phenylacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid benzylpenicillin 6-(2-phenylacetamido)penicillanic acid benzylpenicillinic acid benzylpenicillinum PG PCG bensylpenicillin |
|
| id |
CHEBI:18208 |
|
| in_subset | ||
| inchi |
InChI=1S/C16H18N2O4S/c1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9/h3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22)/t11-,12+,14-/m1/s1 |
|
| inchikey |
JGSARLDLIJGVTE-MBNYWOFBSA-N |
|
| label |
benzylpenicillin |
|
| mass |
334.392 |
|
| monoisotopicmass |
334.09873 |
|
| notation |
CHEBI:18208 |
|
| smiles |
N12C([C@H]([C@]1(SC([C@@H]2C(O)=O)(C)C)[H])NC(CC3=CC=CC=C3)=O)=O |
|
| subClassOf |