Lincomycin

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Properties Simple | Detailed

Formula C18H34N2O6S
IUPAC Name (1r,2s,4r)-n-[(1r,2r)-2-hydroxy-1-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methylsulfanyl-tetrahydropyran-2-yl]propyl]-1-methyl-4-propyl-pyrrolidine-2-carboxamide
Molecular Mass 406.537 g·mol−1
Heat of Formation -1181.1 ± 16.7 kJ·mol−1
Dipole Moment 6.37 ± 1.08 D
Volume 503.46 Å 3
Surface Area 411.11 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy -0.14 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,4r)-n-[(1r,2r)-2-hydroxy-1-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(methylthio)-2-tetrahydropyranyl]propyl]-1-methyl-4-propyl-2-pyrrolidinecarboxamide
  • (2s,4r)-n-[(1r,2r)-2-hydroxy-1-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(methylthio)tetrahydropyran-2-yl]propyl]-1-methyl-4-propyl-pyrrolidine-2-carboxamide
  • (2s,4r)-n-[(1r,2r)-2-hydroxy-1-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methylsulfanyl-oxan-2-yl]propyl]-1-methyl-4-propyl-pyrrolidine-2-carboxamide
  • (2s,4r)-n-[(1r,2r)-2-hydroxy-1-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methylsulfanyl-tetrahydropyran-2-yl]propyl]-1-methyl-4-propyl-pyrrolidine-2-carboxamide
  • (2s,4r)-n-[(1r,2r)-2-hydroxy-1-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-1-methyl-4-propylpyrrolidine-2-carboxamide
  • 154-21-2 (free base)
  • 859-18-7 (hcl)
  • bb_nc-1334
  • d-erythro-.alpha.-d-gluco-octopyranoside, methyl 6,8-dideoxy-6-[[[(2s,4r)-1-methyl-4-propyl-2-pyrrolidinyl]carbonyl]amino]-1-thio-
  • d00223
  • lincomycin (usan/inn)
  • methyl 6,8-dideoxy-6-{[(4r)-1-methyl-4-propyl-l-prolyl]amino}-1-thio-d-erythro-alpha-d-galacto-octopyranoside
  • smp1_000178
InChIKey OJMMVQQUTAEWLP-KIDUDLJLSA-N
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