Ethyl 3-O-(6-Deoxy-α-L-Mannopyranosyl)-2-C-(3-Hydroxy-4-Methoxyphenyl)-Beta-D-Glucopyranoside

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Properties Simple | Detailed

Formula C21H32O12
IUPAC Name 5-[(2r,3r,4s,5r,6r)-2-ethoxy-3,5-dihydroxy-6-(hydroxymethyl)-4-[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-3-yl]-2-methoxy-phenolate
Molecular Mass 476.472 g·mol−1
Heat of Formation -2166.7 ± 16.7 kJ·mol−1
Dipole Moment 5.20 ± 1.08 D
Volume 538.62 Å 3
Surface Area 415.0 Å 2
HOMO Energy -8.67 ± 0.55 eV
LUMO Energy -0.20 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3r,4r,5r,6s)-2-[(2r,3r,4s,5r,6r)-2-ethoxy-3,5-dihydroxy-3-(3-hydroxy-4-methoxy-phenyl)-6-(hydroxymethyl)oxan-4-yl]oxy-6-methyl-oxane-3,4,5-triol
  • (2s,3r,4r,5r,6s)-2-[(2r,3r,4s,5r,6r)-2-ethoxy-3,5-dihydroxy-3-(3-hydroxy-4-methoxy-phenyl)-6-(hydroxymethyl)tetrahydropyran-4-yl]oxy-6-methyl-tetrahydropyran-3,4,5-triol
  • (2s,3r,4r,5r,6s)-2-[(2r,3r,4s,5r,6r)-2-ethoxy-3,5-dihydroxy-3-(3-hydroxy-4-methoxy-phenyl)-6-methylol-tetrahydropyran-4-yl]oxy-6-methyl-tetrahydropyran-3,4,5-triol
  • (2s,3r,4r,5r,6s)-2-[(2r,3r,4s,5r,6r)-2-ethoxy-3,5-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)-6-(hydroxymethyl)oxan-4-yl]oxy-6-methyloxane-3,4,5-triol
  • (2s,3r,4r,5r,6s)-2-[[(2r,3r,4s,5r,6r)-2-ethoxy-3,5-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)-6-(hydroxymethyl)-4-tetrahydropyranyl]oxy]-6-methyltetrahydropyran-3,4,5-triol
  • beta-(3-hydroxy-4-methoxyphenyl)ethyl o-alpha-l-rhamnopyranosyl-(1-3)-o-beta-d-glucopyranoside
  • beta-d-glucopyranoside, 2-(3-hydroxy-4-methoxyphenyl)ethyl 3-o-(6-deoxy-alpha-l-mannopyranosyl)-
  • darendoside b
  • deacyl martynoside
CAS Number(s)
  • 94410-28-3
InChIKey ZLPXZRZUFKQINJ-DDPVKAFRSA-N
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