CHEBI:7005 - morusin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name morusin
ChEBI ID CHEBI:7005
Definition An extended flavonoid that is flavone substituted by hydroxy groups at positions 5, 2' and 4', a prenyl group at position 3 and a 2,2-dimethyl pyran group across positions 7 and 8.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C25H24O6
Net Charge 0
Average Mass 420.45450
Monoisotopic Mass 420.15729
InChI InChI=1S/C25H24O6/c1-13(2)5-7-17-22(29)21-19(28)12-20-16(9-10-25(3,4)31-20)24(21)30-23(17)15-8-6-14(26)11-18(15)27/h5-6,8-12,26-28H,7H2,1-4H3
InChIKey XFFOMNJIDRDDLQ-UHFFFAOYSA-N
SMILES CC(C)=CCc1c(oc2c3C=CC(C)(C)Oc3cc(O)c2c1=O)-c1ccc(O)cc1O
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing morusin (CHEBI:7005) has role antineoplastic agent (CHEBI:35610)
morusin (CHEBI:7005) has role plant metabolite (CHEBI:76924)
morusin (CHEBI:7005) is a extended flavonoid (CHEBI:71037)
morusin (CHEBI:7005) is a trihydroxyflavone (CHEBI:27116)
IUPAC Name
2-(2,4-dihydroxyphenyl)-5-hydroxy-8,8-dimethyl-3-(3-methylbut-2-en-1-yl)-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one
Manual Xrefs Databases
C00001070 KNApSAcK
C10106 KEGG COMPOUND
HMDB0036631 HMDB
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Registry Numbers Types Sources
1442330 Reaxys Registry Number Reaxys
62596-29-6 CAS Registry Number KEGG COMPOUND
62596-29-6 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
25237377 PubMed citation Europe PMC
25476160 PubMed citation Europe PMC
25628938 PubMed citation Europe PMC
Last Modified
16 March 2015