CHEBI:66308 - robustaflavone 7,4',7''-trimethyl ether

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ChEBI Name robustaflavone 7,4',7''-trimethyl ether
ChEBI ID CHEBI:66308
Definition A biflavonoid that is the 7,4',7''-trimethyl ether derivative of robustaflavone. Isolated from Selaginella doederleinii, it exhibits cytotoxic activity against human cancer cell lines.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C33H24O10
Net Charge 0
Average Mass 580.53770
Monoisotopic Mass 580.13695
InChI InChI=1S/C33H24O10/c1-39-19-11-21(35)31-22(36)13-26(43-28(31)12-19)17-6-9-24(40-2)20(10-17)30-27(41-3)15-29-32(33(30)38)23(37)14-25(42-29)16-4-7-18(34)8-5-16/h4-15,34-35,38H,1-3H3
InChIKey NLSFVXZLJDUWJG-UHFFFAOYSA-N
SMILES COc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(OC)c(c1)-c1c(OC)cc2oc(cc(=O)c2c1O)-c1ccc(O)cc1
Metabolite of Species Details
Selaginella doederleinii (NCBI:txid186426) Found in whole plant (BTO:0001461). 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 robustaflavone 7,4',7''-trimethyl ether (CHEBI:66308) has functional parent robustaflavone (CHEBI:8881)
robustaflavone 7,4',7''-trimethyl ether (CHEBI:66308) has role antineoplastic agent (CHEBI:35610)
robustaflavone 7,4',7''-trimethyl ether (CHEBI:66308) has role metabolite (CHEBI:25212)
robustaflavone 7,4',7''-trimethyl ether (CHEBI:66308) is a biflavonoid (CHEBI:50128)
robustaflavone 7,4',7''-trimethyl ether (CHEBI:66308) is a hydroxyflavone (CHEBI:24698)
robustaflavone 7,4',7''-trimethyl ether (CHEBI:66308) is a methoxyflavone (CHEBI:25241)
robustaflavone 7,4',7''-trimethyl ether (CHEBI:66308) is a ring assembly (CHEBI:36820)
IUPAC Name
5-hydroxy-6-[5-(5-hydroxy-7-methoxy-4-oxo-4H-chromen-2-yl)-2-methoxyphenyl]-2-(4-hydroxyphenyl)-7-methoxy-4H-chromen-4-one
Registry Number Type Source
19422339 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
18758121 PubMed citation Europe PMC
Last Modified
08 March 2013