(2S,4Ar,5Ar,7R,7Ar,7Br,8R,11As,12As,12Bs,14As)-2-(α-L-Arabinopyranosyloxy)-1,1,7A,8,12A-Pentamethyl-10-Oxooctadecahydrocyclopropa[1',8A']Naphtho[2',1':4,5]Indeno[2,1-B]Pyran-7-Yl Acetate

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Formula C33H50O9
IUPAC Name (2s,4ar,5ar,7r,7ar,7br,8r,11as,12as,12bs,14as)-2-(alpha-l-arabinopyranosyloxy)-1,1,7a,8,12a-pentamethyl-10-oxooctadecahydrocyclopropa[1',8a']naphtho[2',1':4,5]indeno[2,1-b]pyran-7-yl acetate
Molecular Mass 590.745 g·mol−1
Heat of Formation -1803.1 ± 16.7 kJ·mol−1
Dipole Moment 2.44 ± 1.08 D
Volume 710.24 Å 3
Surface Area 510.18 Å 2
HOMO Energy -9.88 ± 0.55 eV
LUMO Energy 0.63 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,4as,5as,7s,7as,7bs,8s,11ar,12ar)-1,1,7a,8,12a-pentamethyl-10-oxo-2-{[(2r)-3,4,5-trihydroxytetrahydro-2h-pyran-2-yl]oxy}octadecahydrocyclopropa[1',8a']naphtho[2',1':4,5]indeno[2,1-b]pyran-7-yl rel-
  • 12beta-acetoxy-3beta-o-d-xylopyranosyloxy-24,25,26,27-tetranor-9,19-cyclolanost-16,23-lactone
  • 5h-cyclopropa[1',8'a]naphth[2',1':4,5]indeno[2,1-b]pyran-10(2h)-one, 7-(acetyloxy)hexadecahydro-1,1,7a,8,12a-pentamethyl-2-[(1s)-pentopyranosyloxy]-, (2s,4ar,5ar,7r,7ar,7br,11as,12as)-
  • cimilactone a
InChIKey RKTWPXXLEHCPIO-ZCADTKORSA-N
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