CHEBI:3900 - costunolide

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ChEBI Name costunolide
ChEBI ID CHEBI:3900
Definition A germacranolide with anthelminthic, antiparasitic and antiviral activities.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:545296
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Formula C15H20O2
Net Charge 0
Average Mass 232.31810
Monoisotopic Mass 232.146
InChI InChI=1S/C15H20O2/c1-10-5-4-6-11(2)9-14-13(8-7-10)12(3)15(16)17-14/h5,9,13-14H,3-4,6-8H2,1-2H3/b10-5+,11-9+/t13-,14+/m0/s1
InChIKey HRYLQFBHBWLLLL-AHNJNIBGSA-N
SMILES C\C1=C/CC\C(C)=C\[C@H]2OC(=O)C(=C)[C@@H]2CC1
Metabolite of Species Details
Saussurea lappa (NCBI:txid324593) Found in root (BTO:0001188). See: PubMed
Laurus nobilis (NCBI:txid85223) See: PubMed
Magnolia sieboldii (NCBI:txid85868) See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
antiviral drug
A substance used in the prophylaxis or therapy of virus diseases.
Application(s): anthelminthic drug
Substance intended to kill parasitic worms (helminths).
antiinfective agent
A substance used in the prophylaxis or therapy of infectious diseases.
antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
antiparasitic agent
A substance used to treat or prevent parasitic infections.
antiviral drug
A substance used in the prophylaxis or therapy of virus diseases.
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ChEBI Ontology
Outgoing costunolide (CHEBI:3900) has role anthelminthic drug (CHEBI:35443)
costunolide (CHEBI:3900) has role antiinfective agent (CHEBI:35441)
costunolide (CHEBI:3900) has role antineoplastic agent (CHEBI:35610)
costunolide (CHEBI:3900) has role antiparasitic agent (CHEBI:35442)
costunolide (CHEBI:3900) has role antiviral drug (CHEBI:36044)
costunolide (CHEBI:3900) has role metabolite (CHEBI:25212)
costunolide (CHEBI:3900) is a germacranolide (CHEBI:73011)
Incoming 6α-hydroxygermacra-1(10),4,11(13)-trien-12-oate (CHEBI:141318) has functional parent costunolide (CHEBI:3900)
IUPAC Name
(3aS,6E,10E,11aR)-6,10-dimethyl-3-methylene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-2(3H)-one
Synonyms Sources
(+)-costunolide UniProt
(+)-costunolide ChEBI
(10S,1R)-3,7-dimethyl-11-methylene-13-oxabicyclo[8.3.0]trideca-2,6-dien-12-one ChEBI
(3aS,6E,10E)-3-methylene-6,10-dimethyl-2,3,3aβ,4,5,8,9,11aα-octahydrocyclodeca[b]furan-2-one ChEBI
(3aS,6E,10E,11aR)-6,10-dimethyl-3-methylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-2(3H)-one ChEBI
(E,E)-6-alpha-Hydroxygermacra-1(10),4,11(13)-trien-12-oic acid gamma-lactone ChemIDplus
(E,E)-germacra-1(10),4,11(13)-trien-12-oic acid, 6-alpha-hydroxy-gamma-lactone ChemIDplus
Costunlide ChemIDplus
Costunolid ChemIDplus
Costunolide KEGG COMPOUND
Costus lactone ChemIDplus
Manual Xrefs Databases
C00003240 KNApSAcK
C09382 KEGG COMPOUND
Costunolide Wikipedia
KR20000066932 Patent
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Registry Numbers Types Sources
14451 Beilstein Registry Number Beilstein
14451 Reaxys Registry Number Reaxys
553-21-9 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
11534769 PubMed citation Europe PMC
11912066 PubMed citation Europe PMC
14510592 PubMed citation ChEMBL
18409040 PubMed citation Europe PMC
6476889 PubMed citation Europe PMC
Last Modified
28 July 2014