(3Ar,4S,6R,10S,11S,11As)-6-Acetoxy-11-Hydroxy-6,10-Dimethyl-3-Methylene-2,7-Dioxododecahydrocyclodeca[B]Furan-4-Yl Methacrylate

Molecule SVG Image

Properties Simple | Detailed

Formula C21H28O8
IUPAC Name [(3ar,4s,6r,10s,11s,11as)-6-acetoxy-11-hydroxy-6,10-dimethyl-3-methylene-2,7-dioxo-3a,4,5,8,9,10,11,11a-octahydrocyclodeca[b]furan-4-yl] 2-methylprop-2-enoate
Molecular Mass 408.442 g·mol−1
Heat of Formation -1416.0 ± 16.7 kJ·mol−1
Dipole Moment 4.24 ± 1.08 D
Volume 475.61 Å 3
Surface Area 356.45 Å 2
HOMO Energy -9.98 ± 0.55 eV
LUMO Energy -0.28 ± eV
Point Group Symmetry C1
Synonyms
  • (3ar-(3ar*,4s*,6r*,10s*,11s*,11as*))-6-(acetyloxy)dodecahydro-11-hydroxy-6,10-dimethyl-3-methylene-2,7-dioxocyclodeca(b)furan-4-yl 2-methyl-2-propenoate
  • 2-methylacrylic acid [(3ar,4s,6r,10s,11s,11as)-6-acetoxy-11-hydroxy-2,7-diketo-6,10-dimethyl-3-methylene-3a,4,5,8,9,10,11,11a-octahydrocyclodeca[d]furan-4-yl] ester
  • 2-methylprop-2-enoic acid [(3ar,4s,6r,10s,11s,11as)-6-acetoxy-11-hydroxy-6,10-dimethyl-3-methylene-2,7-dioxo-3a,4,5,8,9,10,11,11a-octahydrocyclodeca[b]furan-4-yl] ester
  • 2-propenoic acid, 2-methyl-, 6-(acetyloxy)dodecahydro-11-hydroxy-6,10-dimethyl-3-methylene-2,7-dioxocyclodeca(b)furan-4-yl ester, (3ar-(3ar*,4s*,6r*,10s*,11s*,11as*))-
  • [(3ar,4s,6r,10s,11s,11as)-6-acetoxy-11-hydroxy-6,10-dimethyl-3-methylene-2,7-dioxo-3a,4,5,8,9,10,11,11a-octahydrocyclodeca[b]furan-4-yl] 2-methylprop-2-enoate
  • [(3ar,4s,6r,10s,11s,11as)-6-acetyloxy-11-hydroxy-6,10-dimethyl-3-methylidene-2,7-dioxo-3a,4,5,8,9,10,11,11a-octahydrocyclodeca[b]furan-4-yl] 2-methylprop-2-enoate
  • lychnostatin 1
  • megxp0_000841
CAS Number(s)
  • 128700-83-4
InChIKey OLFNVRXCVQOTPN-ZBTOSGMISA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O