N-[(7R,7Bs,10Ar)-1,2,3,9-Tetramethoxy-8-Oxo-5,6,7,7B,8,10A-Hexahydrobenzo[A]Cyclopenta[3,4]Cyclobuta[1,2-C][7]Annulen-7-Yl]Acetamide

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Properties Simple | Detailed

Formula C22H25NO6
IUPAC Name n-[(7r,7bs,10ar)-1,2,3,9-tetramethoxy-8-oxo-5,6,7,7b,8,10a-hexahydrobenzo[a]cyclopenta[3,4]cyclobuta[1,2-c][7]annulen-7-yl]acetamide
Molecular Mass 399.437 g·mol−1
Heat of Formation -660.6 ± 16.7 kJ·mol−1
Dipole Moment 8.13 ± 1.08 D
Volume 470.61 Å 3
Surface Area 390.89 Å 2
HOMO Energy -8.51 ± 0.55 eV
LUMO Energy -0.44 ± eV
Point Group Symmetry C1
Synonyms
  • (7s-(7alpha,7bbeta,10abeta))-n-(5,6,7,7b,8,10a-hexahydro-1,2,3,9-tetramethoxy-8-oxobenzo(a)cyclopenta(3,4)cyclobuta(1,2-c)cyclohepten-7-yl)acetamide
  • lumicolchicine (9ci)
CAS Number(s)
  • 11039-25-1
InChIKey VKPVZFOUXUQJMW-JCGVRSQUSA-N
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