(2R,4R,4As,5Ar,6S,7S,8R,9S,9Ar,10As)-2-Methyl-6,8-Bis(Methylamino)Octahydro-2H-Pyrano[2,3-B][1,4]Benzodioxine-4,4A,7,9(10Ah)-Tetrol

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Formula C14H26N2O7
IUPAC Name (1r,3s,5r,7r,8s,10r,11s,12s,13r,14s)-5-methyl-11,13-bis(methylamino)-2,4,9-trioxatricyclo[8.4.0.03,8]tetradecane-7,8,12,14-tetrol
Molecular Mass 334.365 g·mol−1
Heat of Formation -1309.4 ± 16.7 kJ·mol−1
Dipole Moment 5.02 ± 1.08 D
Volume 386.55 Å 3
Surface Area 323.39 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy 1.39 ± eV
Point Group Symmetry C1
Synonyms
  • 2h-pyrano(2,3-b)(1,4)benzodioxin-4,4a,7,9(10ah)-tetrol, octahydro-2-methyl-6,8-bis(methylamino)-, (2r-(2alpha,4beta,4abeta,5abeta,6beta,7beta,8beta,9alpha,9aalpha,10abeta))-
  • dihydrospectinomycin
CAS Number(s)
  • 28048-39-7
InChIKey GKPRKJXOTBXASY-IQKNWYLPSA-N
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