Daphnorin

6-methoxy-3-(2-oxochromen-7-yl)oxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one

Also Known As: daphnorin|Daphnorine|Daphnoretin-7-O-beta-D-glucoside|NCGC00247451-01|6-methoxy-3-(2-oxochromen-7-yl)oxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one|6-methoxy-2-oxo-3-[(2-oxo-2h-chromen-7-yl)oxy]-2h-chromen-7-yl |A-d-glucopyranoside|6-Methoxy-2-oxo-3-[(2-oxo-2H-1-benzopyran-7-yl)oxy]-2H-1-benzopyran-7-yl hexopyranoside|3-(2-ketochromen-7-yl)oxy-6-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-coumarin|6-Methoxy-2-oxo-3-[(2-oxo-2H-1-benzopyran-7-yl)oxy]-2H-1-benzopyran-7-yl beta-D-glucopyranoside|6-methoxy-3-(2-oxochromen-7-yl)oxy-7-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxychromen-2-one|6-methoxy-3-[(2-oxo-1-benzopyran-7-yl)oxy]-7-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-1-benzopyran-2-one|7-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-6-methoxy-3-(2-oxidanylidenechromen-7-yl)oxy-chromen-2-one

Molecular Formula	C25H22O12
Molecular Weight	514.11115 g/mol
LogP	1.4
Topological Polar Surface Area	170.0 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	12
Rotatable Bonds	6
Exact Mass	514.11115
Monoisotopic Mass	514.11115
Heavy Atoms	37
Complexity	919.0

Chemical Identifiers

CAS Number	6341-65-7
SMILES	COC1=C(C=C2C(=C1)C=C(C(=O)O2)OC3=CC4=C(C=C3)C=CC(=O)O4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O
InChIKey	WYIIRKFHBPIFQZ-FGBFUVBKSA-N