CHEBI:81064 - Penicillin K

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ChEBI Name Penicillin K
ChEBI ID CHEBI:81064
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C16H26N2O4S
Net Charge 0
Average Mass 342.45400
Monoisotopic Mass 342.161
InChI InChI=1S/C16H26N2O4S/c1-4-5-6-7-8-9-10(19)17-11-13(20)18-12(15(21)22)16(2,3)23-14(11)18/h11-12,14H,4-9H2,1-3H3,(H,17,19)(H,21,22)/t11-,12+,14-/m1/s1
InChIKey XVASOOUVMJAZNJ-MBNYWOFBSA-N
SMILES CCCCCCCC(=O)N[C@H]1[C@H]2SC(C)(C)[C@@H](N2C1=O)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
(via heterocyclic antibiotic )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Penicillin K (CHEBI:81064) is a penicillin (CHEBI:17334)
Synonym Source
Penicillin A KEGG COMPOUND
Database Link Database
C17403 KEGG COMPOUND
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Registry Number Type Source
525-97-3 CAS Registry Number KEGG COMPOUND