Knipholone

Knipholone
	; Atropisomerism of knipholone
Names
	Preferred IUPAC name 1-(3-Acetyl-2,6-dihydroxy-4-methoxyphenyl)-4,5-dihydroxy-2-methylanthracene-9,10-dione
Identifiers
CAS Number	94450-08-5 ;
3D model (JSmol)	Interactive image;
ChEBI	CHEBI:6141;
ChEMBL	ChEMBL514883;
ChemSpider	391095;
KEGG	C10365;
PubChem CID	442753;
CompTox Dashboard (EPA)	DTXSID10331938 ;
	InChI InChI=1S/C24H18O8/c1-9-7-13(27)20-21(22(29)11-5-4-6-12(26)18(11)24(20)31)16(9)19-14(28)8-15(32-3)17(10(2)25)23(19)30/h4-8,26-28,30H,1-3H3 Key: DUENHQWYLVQDQK-UHFFFAOYSA-N; InChI=1/C24H18O8/c1-9-7-13(27)20-21(22(29)11-5-4-6-12(26)18(11)24(20)31)16(9)19-14(28)8-15(32-3)17(10(2)25)23(19)30/h4-8,26-28,30H,1-3H3 Key: DUENHQWYLVQDQK-UHFFFAOYAR;
	SMILES COc1cc(O)c(c(O)c1C(C)=O)-c1c(C)cc(O)c2C(=O)c3c(O)cccc3C(=O)c12;
Properties
Chemical formula	C25H20O8
Molar mass	448.42 g/mol
	Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa). Infobox references

Knipholone is a chemical compound found in the roots of Kniphofia foliosa of the family Asphodelaceae.

References

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