Brickellin

Brickellin
Names
	IUPAC name 2′,5-Dihydroxy-3,4′,5′,6,7-pentamethoxyflavone
	Systematic IUPAC name 5-Hydroxy-2-(2-hydroxy-4,5-dimethoxyphenyl)-3,6,7-trimethoxy-4H-1-benzopyran-4-one
Identifiers
CAS Number	90357-63-4 ;
3D model (JSmol)	Interactive image;
ChEMBL	ChEMBL484666 ;
ChemSpider	10289865 ;
PubChem CID	13871363;
UNII	MQ8CVA2BQ4 ;
CompTox Dashboard (EPA)	DTXSID50551638 ;
	InChI InChI=1S/C20H20O9/c1-24-11-6-9(10(21)7-12(11)25-2)18-20(28-5)17(23)15-13(29-18)8-14(26-3)19(27-4)16(15)22/h6-8,21-22H,1-5H3 Key: USWPTYUGAMOLAB-UHFFFAOYSA-N ; InChI=1/C20H20O9/c1-24-11-6-9(10(21)7-12(11)25-2)18-20(28-5)17(23)15-13(29-18)8-14(26-3)19(27-4)16(15)22/h6-8,21-22H,1-5H3 Key: USWPTYUGAMOLAB-UHFFFAOYAR;
	SMILES COc3cc(C=1Oc2cc(OC)c(OC)c(O)c2C(=O)C=1OC)c(O)cc3OC;
Properties
Chemical formula	C20H20O9
Molar mass	404.371 g·mol−1
Density	1.443 g/mL
	Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa). verify (what is ?) Infobox references

Brickellin is an O-methylated flavonol.^[1] It can be found in Brickellia veronicifolia.^[2]

References

^ Iinuma, M (1985). "Synthesis and revised structure of the flavone brickellin". Phytochemistry. 24 (6): 1367–1368. doi:10.1016/S0031-9422(00)81135-8.
^ Brickellin, a novel flavone from Brickellia veronicaefolia and B. chlorolepis. Roberts M. F., Timmermann B. N., Mabry T. J., Brown R. and Matlin S. A., Phytochemistry, 1984, volume 23, no 1, pages 163-165, INIST 9471694

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Names

IUPAC name 2′,5-Dihydroxy-3,4′,5′,6,7-pentamethoxyflavone
Systematic IUPAC name 5-Hydroxy-2-(2-hydroxy-4,5-dimethoxyphenyl)-3,6,7-trimethoxy-4H-1-benzopyran-4-one
Identifiers
CAS Number	90357-63-4^N
3D model (JSmol)	Interactive image
ChEMBL	ChEMBL484666^Y
ChemSpider	10289865^Y
PubChem CID	13871363
UNII	MQ8CVA2BQ4^Y
CompTox Dashboard (EPA)	DTXSID50551638
InChI InChI=1S/C20H20O9/c1-24-11-6-9(10(21)7-12(11)25-2)18-20(28-5)17(23)15-13(29-18)8-14(26-3)19(27-4)16(15)22/h6-8,21-22H,1-5H3^Y Key: USWPTYUGAMOLAB-UHFFFAOYSA-N^Y InChI=1/C20H20O9/c1-24-11-6-9(10(21)7-12(11)25-2)18-20(28-5)17(23)15-13(29-18)8-14(26-3)19(27-4)16(15)22/h6-8,21-22H,1-5H3 Key: USWPTYUGAMOLAB-UHFFFAOYAR
SMILES COc3cc(C=1Oc2cc(OC)c(OC)c(O)c2C(=O)C=1OC)c(O)cc3OC
Properties
Chemical formula	C₂₀H₂₀O₉
Molar mass	404.371 g·mol⁻¹
Density	1.443 g/mL
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa). N verify (what is ^YN ?) Infobox references