CHEBI:66016 - hirsutellide A

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ChEBI Name hirsutellide A
ChEBI ID CHEBI:66016
Definition A cyclodepsipeptide isolated from the cell extract of the entomopathogenic fungus Hirsutella kobayasii BCC 1660 and exhibits antimycobacterial and antimalarial activities.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C36H48N4O8
Net Charge 0
Average Mass 664.78830
Monoisotopic Mass 664.34721
InChI InChI=1S/C36H48N4O8/c1-7-23(3)31-35(45)39(5)21-29(41)48-28(20-26-17-13-10-14-18-26)34(44)38-32(24(4)8-2)36(46)40(6)22-30(42)47-27(33(43)37-31)19-25-15-11-9-12-16-25/h9-18,23-24,27-28,31-32H,7-8,19-22H2,1-6H3,(H,37,43)(H,38,44)/t23-,24-,27-,28-,31+,32+/m1/s1
InChIKey PMRINUPHTRWJOC-BZPSDGNJSA-N
SMILES [H][C@]1(NC(=O)[C@@H](Cc2ccccc2)OC(=O)CN(C)C(=O)[C@@]([H])(NC(=O)[C@@H](Cc2ccccc2)OC(=O)CN(C)C1=O)[C@H](C)CC)[C@H](C)CC
Metabolite of Species Details
Hirsutella kobayasii (NCBI:txid42367) See: PubMed
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
antimycobacterial drug
A drug used to treat or prevent infections caused by Mycobacteria, a genus of actinobacteria. Aerobic and nonmotile, members of the genus include the pathogens responsible for causing tuberculosis and leprosy.
antimalarial
A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human.
Application(s): antimycobacterial drug
A drug used to treat or prevent infections caused by Mycobacteria, a genus of actinobacteria. Aerobic and nonmotile, members of the genus include the pathogens responsible for causing tuberculosis and leprosy.
antimalarial
A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing hirsutellide A (CHEBI:66016) has role antimalarial (CHEBI:38068)
hirsutellide A (CHEBI:66016) has role antimycobacterial drug (CHEBI:64912)
hirsutellide A (CHEBI:66016) has role metabolite (CHEBI:25212)
hirsutellide A (CHEBI:66016) is a cyclodepsipeptide (CHEBI:35213)
hirsutellide A (CHEBI:66016) is a macrocycle (CHEBI:51026)
IUPAC Name
(6S,9R,15S,18R)-9,18-dibenzyl-6,15-di[(2R)-butan-2-yl]-4,13-dimethyl-1,10-dioxa-4,7,13,16-tetraazacyclooctadecane-2,5,8,11,14,17-hexone
Registry Number Type Source
9309812 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
12350163 PubMed citation Europe PMC
18007294 PubMed citation Europe PMC
Last Modified
20 February 2013