Methyl (4Br,7Ar,8Ar,9R,10R,12Ar,12Bs)-13-Acetyl-7,10-Dimethyl-5,6,7,7A,8,8A,9,10,12,12A,12B,13-Dodecahydropyrano[3,4-A]Pyrrolo[2,3-D]Carbazole-9-Carboxylate

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Formula C23H30N2O4
IUPAC Name methyl (4br,7ar,8ar,9r,10r,12ar,12bs)-13-acetyl-7,10-dimethyl-5,6,7,7a,8,8a,9,10,12,12a,12b,13-dodecahydropyrano[3,4-a]pyrrolo[2,3-d]carbazole-9-carboxylate
Molecular Mass 398.495 g·mol−1
Heat of Formation -636.4 ± 16.7 kJ·mol−1
Dipole Moment 4.34 ± 1.08 D
Volume 476.75 Å 3
Surface Area 367.97 Å 2
HOMO Energy -8.51 ± 0.55 eV
LUMO Energy 0.26 ± eV
Point Group Symmetry C1
Synonyms
  • ( )-malagashanine
  • malagashanine
  • pyrano(3,4-a)pyrrolo(2,3-d)carbazole-9-carboxylic acid, 13-acetyl-5,6,7,7a,8,8a,9,10,12,12a,12b,13-dodecahydro-7,10-dimethyl-, methyl ester, (4br,7ar,8ar,9r,10r,12ar,12bs)-
CAS Number(s)
  • 139682-33-0
InChIKey MUNURTJJRWIXFH-IXBAYOQISA-N
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