1-O-(4-Hydroxy-2-Methylenebutanoyl)-β-D-Glucopyranose

Molecule SVG Image

Properties Simple | Detailed

Formula C11H18O8
IUPAC Name [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] 4-hydroxy-2-methylene-butanoate
Molecular Mass 278.256 g·mol−1
Heat of Formation -1445.1 ± 16.7 kJ·mol−1
Dipole Moment 6.54 ± 1.08 D
Volume 317.26 Å 3
Surface Area 278.2 Å 2
HOMO Energy -10.35 ± 0.55 eV
LUMO Energy -0.23 ± eV
Point Group Symmetry C1
Synonyms
  • 1-tuliposide a
  • 2-(2-hydroxyethyl)acrylic acid [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl] ester
  • 4-hydroxy-2-methylenebutanoic acid [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl] ester
  • [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 4-hydroxy-2-methylidene-butanoate
  • [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 4-hydroxy-2-methylidenebutanoate
  • [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] 4-hydroxy-2-methylene-butanoate
  • beta-d-glucopyranose, 1-(4-hydroxy-2-methylenebutanoate)
  • tuliposide a
CAS Number(s)
  • 19870-30-5
InChIKey SQRUWMQAWMLKPR-DZEUPHNYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O