Clindamycin-2-Phosphate

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Properties Simple | Detailed

Formula C18H34ClN2O8PS
IUPAC Name [(2r,3r,4s,5r,6r)-6-[(1s,2s)-2-chloro-1-[[(1r,2s,4r)-1-methyl-4-propyl-pyrrolidine-2-carbonyl]amino]propyl]-4,5-dihydroxy-2-methylsulfanyl-tetrahydropyran-3-yl] dihydrogen phosphate
Molecular Mass 504.963 g·mol−1
Heat of Formation -1991.1 ± 16.7 kJ·mol−1
Dipole Moment 6.00 ± 1.08 D
Volume 576.58 Å 3
Surface Area 452.81 Å 2
HOMO Energy -8.69 ± 0.55 eV
LUMO Energy -0.48 ± eV
Point Group Symmetry C1
Synonyms
  • (2s-trans)-methyl 7-chloro-6,7,8-trideoxy-6-[[(1- methyl-4-propyl-2-pyrrolidinyl)carbonyl]amino]-1- thio-l-threo-.alpha.-d-galacto-octopyranoside 2- (dihydrogen phosphate)
  • [(2r,3r,4s,5r,6r)-6-[(1s,2s)-2-chloro-1-[[(2s,4r)-1-methyl-4-propyl-pyrrolidin-2-yl]carbonylamino]propyl]-4,5-dihydroxy-2-methylsulfanyl-oxan-3-yl] dihydrogen phosphate
  • [(2r,3r,4s,5r,6r)-6-[(1s,2s)-2-chloro-1-[[(2s,4r)-1-methyl-4-propyl-pyrrolidine-2-carbonyl]amino]propyl]-4,5-dihydroxy-2-(methylthio)tetrahydropyran-3-yl] dihydrogen phosphate
  • [(2r,3r,4s,5r,6r)-6-[(1s,2s)-2-chloro-1-[[(2s,4r)-1-methyl-4-propyl-pyrrolidine-2-carbonyl]amino]propyl]-4,5-dihydroxy-2-methylsulfanyl-tetrahydropyran-3-yl] dihydrogen phosphate
  • [(2r,3r,4s,5r,6r)-6-[(1s,2s)-2-chloro-1-[[(2s,4r)-1-methyl-4-propylpyrrolidine-2-carbonyl]amino]propyl]-4,5-dihydroxy-2-methylsulfanyloxan-3-yl] dihydrogen phosphate
  • [(2r,3r,4s,5r,6r)-6-[(1s,2s)-2-chloro-1-[[[(2s,4r)-1-methyl-4-propyl-2-pyrrolidinyl]-oxomethyl]amino]propyl]-4,5-dihydroxy-2-(methylthio)-3-tetrahydropyranyl] dihydrogen phosphate
  • dalacin t
  • u-28,508
  • u-28508
InChIKey UFUVLHLTWXBHGZ-MGZQPHGTSA-N
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