CHEBI:66602 - lychnostatin 2

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name lychnostatin 2
ChEBI ID CHEBI:66602
Definition A germacranolide isolated from Lychnophora antillana and has been shown to exhibit antineoplastic activity.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C21H28O7
Net Charge 0
Average Mass 392.44280
Monoisotopic Mass 392.18350
InChI InChI=1S/C21H28O7/c1-11(2)19(24)27-16-10-21(6,28-14(5)22)17(23)8-7-12(3)9-15-18(16)13(4)20(25)26-15/h12,15-16,18H,1,4,7-10H2,2-3,5-6H3/t12-,15+,16-,18-,21+/m0/s1
InChIKey HBRKQMNFEIZZOU-AGKHZPTMSA-N
SMILES [H][C@@]12C[C@@H](C)CCC(=O)[C@@](C)(C[C@H](OC(=O)C(C)=C)[C@@]1([H])C(=C)C(=O)O2)OC(C)=O
Metabolite of Species Details
Lychnophora antillana (NCBI:txid41601) Found in leaf (BTO:0000713). See: PubMed
Lychnophora antillana (NCBI:txid41601) Found in stem (BTO:0001300). 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.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing lychnostatin 2 (CHEBI:66602) has role antineoplastic agent (CHEBI:35610)
lychnostatin 2 (CHEBI:66602) has role metabolite (CHEBI:25212)
lychnostatin 2 (CHEBI:66602) is a acetate ester (CHEBI:47622)
lychnostatin 2 (CHEBI:66602) is a cyclic ketone (CHEBI:3992)
lychnostatin 2 (CHEBI:66602) is a germacranolide (CHEBI:73011)
IUPAC Name
(3aS,4S,6R,10S,11aR)-6-(acetyloxy)-6,10-dimethyl-3-methylidene-2,7-dioxododecahydrocyclodeca[b]furan-4-yl 2-methylprop-2-enoate
Registry Number Type Source
128700-84-5 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
2380713 PubMed citation Europe PMC
Last Modified
26 March 2013