CHEBI:68725 - mollicellin L

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ChEBI Name mollicellin L
ChEBI ID CHEBI:68725
Definition A member of the class of depsidones that is 11H-dibenzo[b,e][1,4]dioxepine substituted by a hydroxy group at position 3, a methoxy group at position 7, methyl groups at positions 1 and 9, a 3-methylbut-2-enoyl group at position 8, a formyl group at position 4 and an oxo group at position 11. Isolated from Chaetomium brasiliense, it exhibits antimalarial and cytotoxic activities.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C22H20O7
Net Charge 0
Average Mass 396.39000
Monoisotopic Mass 396.12090
InChI InChI=1S/C22H20O7/c1-10(2)6-15(25)19-12(4)20-17(8-16(19)27-5)28-21-13(9-23)14(24)7-11(3)18(21)22(26)29-20/h6-9,24H,1-5H3
InChIKey SEGGMMXRZJRNCN-UHFFFAOYSA-N
SMILES COc1cc2Oc3c(C=O)c(O)cc(C)c3C(=O)Oc2c(C)c1C(=O)C=C(C)C
Metabolite of Species Details
Chaetomium brasiliense (NCBI:txidtxid155871) See: PubMed
Roles Classification
Biological Role(s): 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.
Chaetomium metabolite
Any fungal metabolite produced during a metabolic reaction in the mould, Chaetomium.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via depsidones )
Application(s): 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.
antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing mollicellin L (CHEBI:68725) has role Chaetomium metabolite (CHEBI:76960)
mollicellin L (CHEBI:68725) has role antimalarial (CHEBI:38068)
mollicellin L (CHEBI:68725) has role antineoplastic agent (CHEBI:35610)
mollicellin L (CHEBI:68725) is a aldehyde (CHEBI:17478)
mollicellin L (CHEBI:68725) is a aromatic ether (CHEBI:35618)
mollicellin L (CHEBI:68725) is a aromatic ketone (CHEBI:76224)
mollicellin L (CHEBI:68725) is a depsidones (CHEBI:75939)
mollicellin L (CHEBI:68725) is a enone (CHEBI:51689)
mollicellin L (CHEBI:68725) is a organic heterotricyclic compound (CHEBI:26979)
mollicellin L (CHEBI:68725) is a phenols (CHEBI:33853)
IUPAC Name
3-hydroxy-7-methoxy-1,9-dimethyl-8-(3-methylbut-2-enoyl)-11-oxo-11H-dibenzo[b,e][1,4]dioxepine-4-carbaldehyde
Manual Xref Database
24654422 ChemSpider
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Registry Number Type Source
19895964 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
19663417 PubMed citation Europe PMC
Last Modified
07 November 2013