2-(3-Hydroxy-4-Methoxyphenyl)Ethyl 3-O-(6-Deoxy-α-L-Mannopyranosyl)-4-O-[(2E)-3-(4-Hydroxy-3-Methoxyphenyl)-2-Propenoyl]-Beta-D-Glucopyranoside

Molecule SVG Image

Properties Simple | Detailed

Formula C31H40O15
IUPAC Name 4-(6-methylene-3,4,5-trioxo-tetrahydropyran-2-yl)oxy-6-(oxomethylene)tetrahydropyran-2,3,5-trione; molecular oxygen; prop-1-yne; prop-1-yn-1-ol
Molecular Mass 652.640 g·mol−1
Heat of Formation -2509.0 ± 16.7 kJ·mol−1
Dipole Moment 4.79 ± 1.08 D
Volume 744.07 Å 3
Surface Area 603.67 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy -1.00 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-3-(4-hydroxy-3-methoxy-phenyl)acrylic acid [(2r,3r,4r,5r,6r)-5-hydroxy-6-[2-(3-hydroxy-4-methoxy-phenyl)ethoxy]-2-methylol-4-[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-3-yl] ester
  • (e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid [(2r,3r,4r,5r,6r)-5-hydroxy-6-[2-(3-hydroxy-4-methoxyphenyl)ethoxy]-2-(hydroxymethyl)-4-[[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-2-tetrahydropyranyl]oxy]-3-tetrahydropyranyl] ester
  • [(2r,3r,4r,5r,6r)-5-hydroxy-6-[2-(3-hydroxy-4-methoxy-phenyl)ethoxy]-2-(hydroxymethyl)-4-[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-oxan-3-yl] (e)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoate
  • [(2r,3r,4r,5r,6r)-5-hydroxy-6-[2-(3-hydroxy-4-methoxy-phenyl)ethoxy]-2-(hydroxymethyl)-4-[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-3-yl] (e)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoate
  • [(2r,3r,4r,5r,6r)-5-hydroxy-6-[2-(3-hydroxy-4-methoxyphenyl)ethoxy]-2-(hydroxymethyl)-4-[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
  • martynoside
InChIKey WLWAYPFRKDSFCL-CNMJWYMJSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O