Xanthorhamnin

3-[(2S,3R,4S,5R,6R)-6-[[(2R,3R,4R,5S,6S)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxychromen-4-one

Also Known As: Xanthorhamnin|Xanthorhamnin B|Compound NP-000535|MEGxp0_000215|ACon1_002043|C.I. 75695|NCGC00179887-01|3-[(2S,3R,4S,5R,6R)-6-[[(2R,3R,4R,5S,6S)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxychromen-4-one|3-[6-[[3,5-dihydroxy-6-methyl-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxychromen-4-one|4H-1-Benzopyran-4-one, 3-((o-6-deoxy-alpha-L-mannopyranosyl-(1->3)-o-6-deoxy-alpha-L-mannopyranosyl-(1->6)-beta-D-galactopyranosyl)oxy)-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxy-|2-(3,4-Dihydroxyphenyl)-5-hydroxy-7-methoxy-4-oxo-4H-1-benzopyran-3-yl 6-deoxy-alpha-L-mannopyranosyl-(1->3)-6-deoxy-alpha-L-mannopyranosyl-(1->6)-beta-D-galactopyranoside|3-((2S,3R,4S,5R,6R)-6-(((2R,3R,4R,5S,6S)-3,5-dihydroxy-6-methyl-4-((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl)oxymethyl)-3,4,5-trihydroxyoxan-2-yl)oxy-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxychromen-4-one|3-[[6-O-(3-O-alpha-L-Rhamnopyranosyl-alpha-L-rhamnopyranosyl)-beta-D-galactopyranosyl]oxy]-3 ,4 ,5-trihydroxy-7-methoxyflavone|3-[6-O-[3-O-(alpha-L-Rhamnopyranosyl)-alpha-L-rhamnopyranosyl]-beta-D-galactopyranosyloxy]-5-hydroxy-2-(3,4-dihydroxyphenyl)-7-methoxy-4H-1-benzopyran-4-one|3-{[(2S,3R,4S,5R,6R)-6-({[(2R,3R,4R,5S,6S)-3,5-dihydroxy-6-methyl-4-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxy-4H-chromen-4-one|4H-1-Benzopyran-4-one, 3-[(O-6-deoxy-alpha-L-mannopyranosyl-(1-->3)-O-6-deoxy-alpha-L-mannopyranosyl-(1-->6)-beta-D-galactopyranosyl)oxy]-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxy-|7-Methoxy-3 ,4 ,5-trihydroxy-3-[6-O-[3-O-(alpha-L-rhamnopyranosyl)-alpha-L-rhamnopyranosyl]-beta-D-galactopyranosyloxy]flavone

Molecular Formula	C34H42O20
Molecular Weight	770.2269 g/mol
LogP	-2.5323
Topological Polar Surface Area	317.35 Ų
Hydrogen Bond Donors	11
Hydrogen Bond Acceptors	20
Rotatable Bonds	9
Exact Mass	770.2269
Monoisotopic Mass	770.2269
Heavy Atoms	54
Complexity	1852.0188

Chemical Identifiers

CAS Number	71241-97-9
SMILES	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H](O[C@H]([C@@H]2O)OC[C@@H]3[C@@H]([C@@H]([C@H]([C@@H](O3)OC4=C(OC5=CC(=CC(=C5C4=O)O)OC)C6=CC(=C(C=C6)O)O)O)O)O)C)O)O)O)O