CHEBI:66012 - herquline B

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ChEBI Name herquline B
ChEBI ID CHEBI:66012
Definition An alkaloid comprising of a piperazine and cyclohexenone ring systems. Isolated from Penicillium herquei, it exhibits inhibitory activity against platelet aggregation.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C19H26N2O2
Net Charge 0
Average Mass 314.42190
Monoisotopic Mass 314.19943
InChI InChI=1S/C19H26N2O2/c1-21-11-14-6-12-2-4-18(22)16(8-12)17-9-13(3-5-19(17)23)7-15(21)10-20-14/h8-9,14-17,20H,2-7,10-11H2,1H3
InChIKey IKEHAWAEPHQJSM-UHFFFAOYSA-N
SMILES CN1CC2CC3=CC(C4C=C(CCC4=O)CC1CN2)C(=O)CC3
Metabolite of Species Details
Penicillium herquei (NCBI:txid69774) of strain FG 37 See: PubMed
Roles Classification
Biological Role(s): Penicillium metabolite
Any fungal metabolite produced during a metabolic reaction in Penicillium.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
Application(s): platelet aggregation inhibitor
A drug or agent which antagonizes or impairs any mechanism leading to blood platelet aggregation, whether during the phases of activation and shape change or following the dense-granule release reaction and stimulation of the prostaglandin-thromboxane system.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing herquline B (CHEBI:66012) has role Penicillium metabolite (CHEBI:76964)
herquline B (CHEBI:66012) has role platelet aggregation inhibitor (CHEBI:50427)
herquline B (CHEBI:66012) is a alkaloid (CHEBI:22315)
herquline B (CHEBI:66012) is a cyclic ketone (CHEBI:3992)
Synonym Source
15-methyl-15,17-diazatetracyclo[12.2.2.13,7.18,12]icosa-3(20),12(19)-diene-6,9-dione ChEBI
Registry Number Type Source
7436484 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
8609085 PubMed citation Europe PMC
Last Modified
13 January 2014