Iso-Rhamnetin 3-O-Robinobioside

Molecule SVG Image

Properties Simple | Detailed

Formula C28H33O16+
IUPAC Name 5,7-dihydroxy-2-(4-hydroxy-3-methoxy-phenyl)-3-[(2s,3r,4s,5r,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-chromen-4-one
Molecular Mass 625.552 g·mol−1
Heat of Formation -2630.0 ± 16.7 kJ·mol−1
Dipole Moment 8.54 ± 1.08 D
Volume 673.84 Å 3
Surface Area 480.36 Å 2
HOMO Energy -9.01 ± 0.55 eV
LUMO Energy -1.03 ± eV
Point Group Symmetry C1
Synonyms
  • 4h-1-benzopyran-4-one, 3-((6-o-(6-deoxy-alpha-l-mannopyranosyl)-beta-d-galactopyranosyl)oxy)-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-
  • 5,7-dihydroxy-2-(4-hydroxy-3-methoxy-phenyl)-3-[(2s,3r,4s,5r,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-chromen-4-one
  • 5,7-dihydroxy-2-(4-hydroxy-3-methoxy-phenyl)-3-[(2s,3r,4s,5r,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-chromen-4-one
  • 5,7-dihydroxy-2-(4-hydroxy-3-methoxy-phenyl)-3-[(2s,3r,4s,5r,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-chromone
  • 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-[[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one
  • 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-[[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-2-tetrahydropyranyl]oxymethyl]-2-tetrahydropyranyl]oxy]-4-chromenone
  • acon0_001014
  • acon1_000130
  • i-rha-gal
  • isorhamnetin 3-o-alpha-rhamnopyranosyl-(1-2)-beta-galactopyranoside
  • megxp0_000109
CAS Number(s)
  • 107740-46-5
InChIKey UIDGLYUNOUKLBM-ZLADREHTSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O