Aviculin

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Formula C26H34O10
IUPAC Name (2r,3r,4r,5r,6s)-2-[[(1s,2r,3r)-7-hydroxy-1-(4-hydroxy-3-methoxy-phenyl)-3-(hydroxymethyl)-6-methoxy-tetralin-2-yl]methoxy]-6-methyl-tetrahydropyran-3,4,5-triol
Molecular Mass 506.542 g·mol−1
Heat of Formation -1721.6 ± 16.7 kJ·mol−1
Dipole Moment 4.67 ± 1.08 D
Volume 588.62 Å 3
Surface Area 463.37 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy -0.05 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4r,5r,6s)-2-[[(1s,2r,3r)-7-hydroxy-1-(4-hydroxy-3-methoxy-phenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-methyl-oxane-3,4,5-triol
  • (2r,3r,4r,5r,6s)-2-[[(1s,2r,3r)-7-hydroxy-1-(4-hydroxy-3-methoxy-phenyl)-3-(hydroxymethyl)-6-methoxy-tetralin-2-yl]methoxy]-6-methyl-tetrahydropyran-3,4,5-triol
  • (2r,3r,4r,5r,6s)-2-[[(1s,2r,3r)-7-hydroxy-1-(4-hydroxy-3-methoxy-phenyl)-6-methoxy-3-methylol-tetralin-2-yl]methoxy]-6-methyl-tetrahydropyran-3,4,5-triol
  • (2r,3r,4r,5r,6s)-2-[[(1s,2r,3r)-7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-methyloxane-3,4,5-triol
  • (2r,3r,4r,5r,6s)-2-[[(1s,2r,3r)-7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6-methoxy-2-tetralinyl]methoxy]-6-methyltetrahydropyran-3,4,5-triol
InChIKey FPJFPMQEUVMUKU-CDDCGRQRSA-N
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