(2S)-2-(3,4-Dimethoxyphenyl)-5-Hydroxy-4-Oxo-3,4-Dihydro-2H-Chromen-7-Yl 6-O-(6-Deoxy-α-L-Mannopyranosyl)-Beta-D-Mannopyranoside

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Properties Simple | Detailed

Formula C29H36O15
IUPAC Name (2s)-2-(3,4-dimethoxyphenyl)-5-hydroxy-7-[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-[[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-chroman-4-one
Molecular Mass 624.587 g·mol−1
Heat of Formation -2573.4 ± 16.7 kJ·mol−1
Dipole Moment 2.08 ± 1.08 D
Volume 675.89 Å 3
Surface Area 485.4 Å 2
HOMO Energy -8.57 ± 0.55 eV
LUMO Energy 2.31 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-(3,4-dimethoxyphenyl)-5-hydroxy-7-[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-[[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxymethyl]oxan-2-yl]oxy-chroman-4-one
  • (2s)-2-(3,4-dimethoxyphenyl)-5-hydroxy-7-[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-[[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-chroman-4-one
  • (2s)-2-(3,4-dimethoxyphenyl)-5-hydroxy-7-[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-[[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychroman-4-one
  • (2s)-2-(3,4-dimethoxyphenyl)-5-hydroxy-7-[[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-[[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-2-tetrahydropyranyl]oxymethyl]-2-tetrahydropyranyl]oxy]-4-chromanone
  • 4h-1-benzopyran-4-one, 7-((6-o-(6-deoxy-alpha-l-mannopyranosyl)-beta-d-glucopyranosyl)oxy)-2,3-dihydro-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-, monomethyl ether, (2s)-
  • methyl hesperidin
  • methylhesperidin
CAS Number(s)
  • 11013-97-1
InChIKey GUMSHIGGVOJLBP-CTUUZZHSSA-N
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