Saframycin C

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Properties Simple | Detailed

Formula C20H29N3O9
IUPAC Name saframycin c
Molecular Mass 455.459 g·mol−1
Heat of Formation -1097.1 ± 16.7 kJ·mol−1
Dipole Moment 3.38 ± 1.08 D
Volume 650.09 Å 3
Surface Area 476.95 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy -1.65 ± eV
Point Group Symmetry C1
Synonyms
  • propanamide, n-((1,5,6,7,9,10,13,14,14a,15-decahydro-2,5,11-trimethoxy-3,12,16-trimethyl-1,4,10,13-tetraoxo-6,15-imino-4h-isoquino(3,2-b)(3)benzazocin-9-yl)methyl)-2-oxo-, (5s-(5-alpha,6-alpha,9-beta,14a-alpha,15-alpha))-
CAS Number(s)
  • 66082-29-9
InChIKey JIJFDUYXCLTCFT-FZLBTGRLSA-N
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