Silvestrol

Molecule SVG Image

Properties Simple | Detailed

Formula C34H38O13
IUPAC Name methyl (1r,2r,3s,3ar,8bs)-6-[[(2s,3r,6r)-6-[(1r)-1,2-dihydroxyethyl]-3-methoxy-1,4-dioxan-2-yl]oxy]-1,8b-dihydroxy-8-methoxy-3a-(4-methoxyphenyl)-3-phenyl-2,3-dihydro-1h-cyclopenta[b]benzofuran-2-carboxylate
Molecular Mass 654.658 g·mol−1
Heat of Formation -1991.1 ± 16.7 kJ·mol−1
Dipole Moment 3.29 ± 1.08 D
Volume 737.35 Å 3
Surface Area 548.95 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy -0.20 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,2r,3s,3ar,8bs)-6-[[(2s,3r,6r)-6-[(1r)-1,2-dihydroxyethyl]-3-methoxy-1,4-dioxan-2-yl]oxy]-1,8b-dihydroxy-8-methoxy-3a-(4-methoxyphenyl)-3-phenyl-2,3-dihydro-1h-cyclopenta[b]benzofuran-2-carboxylic acid methyl ester
  • methyl (1r,2r,3s,3ar,8bs)-6-[[(2s,3r,6r)-6-[(1r)-1,2-dihydroxyethyl]-3-methoxy-1,4-dioxan-2-yl]oxy]-1,8b-dihydroxy-8-methoxy-3a-(4-methoxyphenyl)-3-phenyl-2,3-dihydro-1h-cyclopenta[b]benzofuran-2-carboxylate
InChIKey GVKXFVCXBFGBCD-QKDMMWSPSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O