CHEBI:66136 - kalimantacin B

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ChEBI Name kalimantacin B
ChEBI ID CHEBI:66136
Definition A fatty acid derivative isolated from the fermentation broth of Alcaligenes sp. YL-02632S. It is an antibiotic with antibacterial activity.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C30H48N2O7
Net Charge 0
Average Mass 548.71130
Monoisotopic Mass 548.34615
InChI InChI=1S/C30H48N2O7/c1-20(14-22(3)15-23(4)17-28(35)36)12-10-8-7-9-11-13-21(2)16-26(33)18-27(34)19-32-29(37)24(5)25(6)39-30(31)38/h7-9,11,17,21-22,24-25,27,34H,1,10,12-16,18-19H2,2-6H3,(H2,31,38)(H,32,37)(H,35,36)/b8-7+,11-9+,23-17+
InChIKey GENAAYFYLGYPIQ-FFPWVZAVSA-N
SMILES CC(C\C=C\C=C\CCC(=C)CC(C)C\C(C)=C\C(O)=O)CC(=O)CC(O)CNC(=O)C(C)C(C)OC(N)=O
Metabolite of Species Details
Alcaligenes sp. (NCBI:txid512) of strain YL 02632S See: PubMed
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): bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
antibacterial agent
A substance (or active part thereof) that kills or slows the growth of bacteria.
antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing kalimantacin B (CHEBI:66136) has role antibacterial agent (CHEBI:33282)
kalimantacin B (CHEBI:66136) has role antimicrobial agent (CHEBI:33281)
kalimantacin B (CHEBI:66136) has role bacterial metabolite (CHEBI:76969)
kalimantacin B (CHEBI:66136) is a α,β-unsaturated monocarboxylic acid (CHEBI:79020)
kalimantacin B (CHEBI:66136) is a carbamate ester (CHEBI:23003)
kalimantacin B (CHEBI:66136) is a fatty acid derivative (CHEBI:61697)
kalimantacin B (CHEBI:66136) is a secondary carboxamide (CHEBI:140325)
IUPAC Name
(2E,10E,12E)-20-{[3-(carbamoyloxy)-2-methylbutanoyl]amino}-19-hydroxy-3,5,15-trimethyl-7-methylidene-17-oxoicosa-2,10,12-trienoic acid
Registry Number Type Source
21369092 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
8621352 PubMed citation Europe PMC
Last Modified
07 March 2018