Magnolioside structure

Magnolioside

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

Also Known As: Magnolioside|Methylesculin|Esculin methyl ether|ISOSCOPOLIN|7-METHYLESCULIN|AESCULIN METHYL ETHER|ISOSCOPOLETIN-BETA-D-GLUCOSIDE|HY-N7034|ISOSCOPOLETIN-.BETA.-D-GLUCOSIDE|TN1905|2H-1-Benzopyran-2-one, 6-(beta-D-glucopyranosyloxy)-7-methoxy-|ISOSCOPOLETIN .BETA.-D-GLUCOPYRANOSIDE|7-methoxycoumarin-6-beta-D-glucopyranoside|ISOSCOPOLETIN BETA-D-GLUCOPYRANOSIDE|6-(beta-D-Glucopyranosyloxy)-7-methoxycoumarin|7-methoxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one|7-Methoxy-2-oxo-2H-1-benzopyran-6-yl hexopyranoside|6-(BETA-D-GLUCOPYRANOSYLOXY)-7-METHOXY-2H-1-BENZOPYRAN-2-ONE|2H-1-Benzopyran-2-one, 6-(b-D-glucopyranosyloxy)-7-methoxy-|6-(.BETA.-D-GLUCOPYRANOSYLOXY)-7-METHOXY-2H-1-BENZOPYRAN-2-ONE|7-Methoxy-2-oxo-2H-1-benzopyran-6-yl beta-D-glucopyranoside|(2-Oxo-7-methoxy-2H-1-benzopyran)-6-yl beta-D-glucopyranoside|2H-1-Benzopyran-2-one, 6-(|A-D-glucopyranosyloxy)-7-methoxy-|7-methoxy-6-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-chromen-2-one|7-methoxy-6-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxychromen-2-one|7-methoxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-2-one|7-METHOXY-6-{[(2S,3R,4S,5S,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL]OXY}CHROMEN-2-ONE|NCGC00380360-01!7-methoxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one

CAS: 20186-29-2
Molecular Formula C16H18O9
Molecular Weight 354.0951 g/mol
LogP -1.0197
Topological Polar Surface Area 138.82 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 9
Rotatable Bonds 4
Exact Mass 354.0951
Monoisotopic Mass 354.0951
Heavy Atoms 25
Complexity 799.7822

Chemical Identifiers

CAS Number 20186-29-2
SMILES COC1=C(C=C2C=CC(=O)OC2=C1)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O

Product Overview

Magnolioside (CAS 20186-29-2), with molecular formula C16H18O9 and molecular weight 354.0951 g/mol. IUPAC: 7-methoxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one.

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