CHEBI:65441 - artoindonesianin E1

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ChEBI Name artoindonesianin E1
ChEBI ID CHEBI:65441
Definition An extended flavonoid that is 6,7-dihydro-8H-chromeno[3,2-d][1]benzoxepin-8-one substituted by hydroxy groups at positions 3 and 9, a methoxy group at position 11, a (1E)-3-methylbut-1-en-1-yl group at position 10 and a prop-1-en-2-yl at position 6. It is isolated from the woods of Artocarpus elasticus and shows moderate cytotoxicity against murine leukemia P-388 cells.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C26H26O6
Net Charge 0
Average Mass 434.48100
Monoisotopic Mass 434.17294
InChI InChI=1S/C26H26O6/c1-13(2)6-8-16-20(30-5)12-22-23(24(16)28)25(29)18-11-19(14(3)4)31-21-10-15(27)7-9-17(21)26(18)32-22/h6-10,12-13,19,27-28H,3,11H2,1-2,4-5H3/b8-6+
InChIKey KULOJVAPXYSRNQ-SOFGYWHQSA-N
SMILES COc1cc2oc3-c4ccc(O)cc4OC(Cc3c(=O)c2c(O)c1\C=C\C(C)C)C(C)=C
Metabolite of Species Details
Artocarpus elasticus (NCBI:txid709042) Found in xylem (BTO:0001468). Previous component: wood; 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 artoindonesianin E1 (CHEBI:65441) has role antineoplastic agent (CHEBI:35610)
artoindonesianin E1 (CHEBI:65441) has role metabolite (CHEBI:25212)
artoindonesianin E1 (CHEBI:65441) is a aromatic ether (CHEBI:35618)
artoindonesianin E1 (CHEBI:65441) is a extended flavonoid (CHEBI:71037)
artoindonesianin E1 (CHEBI:65441) is a organic heterotetracyclic compound (CHEBI:38163)
IUPAC Name
3,9-dihydroxy-11-methoxy-10-[(1E)-3-methylbut-1-en-1-yl]-6-(prop-1-en-2-yl)-6,7-dihydro-8H-chromeno[3,2-d][1]benzoxepin-8-one
Citation Waiting for Citations Type Source
19280147 PubMed citation Europe PMC
Last Modified
12 July 2013