CHEBI:35047 - xanthomicrol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name xanthomicrol
ChEBI ID CHEBI:35047
Definition A trimethoxyflavone that is flavone substituted by methoxy groups at positions 6, 7 and 8 and hydroxy groups at positions 5 and 4'.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C18H16O7
Net Charge 0
Average Mass 344.31540
Monoisotopic Mass 344.08960
InChI InChI=1S/C18H16O7/c1-22-16-14(21)13-11(20)8-12(9-4-6-10(19)7-5-9)25-15(13)17(23-2)18(16)24-3/h4-8,19,21H,1-3H3
InChIKey SAMBWAJRKKEEOR-UHFFFAOYSA-N
SMILES COc1c(O)c2c(oc(cc2=O)-c2ccc(O)cc2)c(OC)c1OC
Metabolite of Species Details
Dracocephalum kotschyi (NCBI:txid180015) Found in leaf (BTO:0000713). See: PubMed
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 xanthomicrol (CHEBI:35047) has functional parent flavone (CHEBI:42491)
xanthomicrol (CHEBI:35047) has role antineoplastic agent (CHEBI:35610)
xanthomicrol (CHEBI:35047) has role plant metabolite (CHEBI:76924)
xanthomicrol (CHEBI:35047) is a dihydroxyflavone (CHEBI:38686)
xanthomicrol (CHEBI:35047) is a trimethoxyflavone (CHEBI:27124)
IUPAC Name
5-hydroxy-2-(4-hydroxyphenyl)-6,7,8-trimethoxy-4H-chromen-4-one
Synonym Source
4',5-dihydroxy-6,7,8-trimethoxyflavone KEGG COMPOUND
Manual Xrefs Databases
C00003879 KNApSAcK
C14476 KEGG COMPOUND
HMDB0037600 HMDB
LMPK12111447 LIPID MAPS
View more database links
Registry Numbers Types Sources
16545-23-6 CAS Registry Number KEGG COMPOUND
16545-23-6 CAS Registry Number ChemIDplus
344488 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
15949825 PubMed citation Europe PMC
23768339 PubMed citation Europe PMC
24895220 PubMed citation Europe PMC
25138085 PubMed citation Europe PMC
Last Modified
16 October 2014