CHEBI:204879 - 8'-O-demythylisonigerone

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 8'-O-demythylisonigerone
ChEBI ID CHEBI:204879
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C31H24O10
Net Charge 0
Average Mass 556.523
Monoisotopic Mass 556.13695
InChI InChI=1S/C31H24O10/c1-12-6-19(34)27-29(36)24(16-8-14(32)9-20(38-4)23(16)30(27)40-12)25-17-10-15(37-3)11-21(39-5)22(17)28(35)26-18(33)7-13(2)41-31(25)26/h6-11,34-36H,1-5H3
InChIKey CCKOABUIUQQNAY-UHFFFAOYSA-N
SMILES O=C1C=2C(OC(=C1)C)=C(C3=C(O)C=4C(OC(C)=CC4O)=C5C3=CC(=O)C=C5OC)C6=CC(OC)=CC(=C6C2O)OC
Metabolite of Species Details
Aspergillus (NCBI:txid5052) See: PubMed
ChEBI Ontology
Outgoing 8'-O-demythylisonigerone (CHEBI:204879) is a organic heterotricyclic compound (CHEBI:26979)
8'-O-demythylisonigerone (CHEBI:204879) is a organooxygen compound (CHEBI:36963)
IUPAC Name
4,5-dihydroxy-6-(5-hydroxy-6,8-dimethoxy-2-methyl-4-oxobenzo[g]chromen-10-yl)-10-methoxy-2-methylbenzo[h]chromen-8-one
Manual Xref Database
78435636 ChemSpider
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