CHEBI:7602 - nobiletin

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ChEBI Name nobiletin
ChEBI ID CHEBI:7602
Definition A methoxyflavone that is flavone substituted by methoxy groups at positions 5, 6, 7, 8, 3' and 4' respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ChemicalBook:CB3740677, eMolecules:734064, Selleckchem:Nobiletin(Hexamethoxyflavone), ZINC000001531669
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Formula C21H22O8
Net Charge 0
Average Mass 402.39460
Monoisotopic Mass 402.13147
InChI InChI=1S/C21H22O8/c1-23-13-8-7-11(9-15(13)24-2)14-10-12(22)16-17(25-3)19(26-4)21(28-6)20(27-5)18(16)29-14/h7-10H,1-6H3
InChIKey MRIAQLRQZPPODS-UHFFFAOYSA-N
SMILES COc1ccc(cc1OC)-c1cc(=O)c2c(OC)c(OC)c(OC)c(OC)c2o1
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.
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ChEBI Ontology
Outgoing nobiletin (CHEBI:7602) has functional parent flavone (CHEBI:42491)
nobiletin (CHEBI:7602) has role antineoplastic agent (CHEBI:35610)
nobiletin (CHEBI:7602) has role plant metabolite (CHEBI:76924)
nobiletin (CHEBI:7602) is a methoxyflavone (CHEBI:25241)
IUPAC Name
2-(3,4-dimethoxyphenyl)-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one
Synonyms Sources
5,6,7,8,3',4'-Hexamethoxyflavone KEGG COMPOUND
Hexamethoxyflavone KEGG COMPOUND
Manual Xrefs Databases
C00001076 KNApSAcK
C10112 KEGG COMPOUND
HMDB0029540 HMDB
LMPK12111468 LIPID MAPS
LSM-2130 LINCS
Nobiletin Wikipedia
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Registry Numbers Types Sources
360887 Reaxys Registry Number Reaxys
478-01-3 CAS Registry Number ChemIDplus
478-01-3 CAS Registry Number NIST Chemistry WebBook
Citations Waiting for Citations
Last Modified
24 February 2016