Clindamycin

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Properties Simple | Detailed

Formula C18H33ClN2O5S
IUPAC Name (1r,2s,4r)-n-[(1s,2s)-2-chloro-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 424.983 g·mol−1
Heat of Formation -1090.0 ± 16.7 kJ·mol−1
Dipole Moment 4.26 ± 1.08 D
Volume 508.27 Å 3
Surface Area 407.21 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy -0.04 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,4r)-n-[(1s,2s)-2-chloro-1-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(methylthio)-2-tetrahydropyranyl]propyl]-1-methyl-4-propyl-2-pyrrolidinecarboxamide
  • (2s,4r)-n-[(1s,2s)-2-chloro-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-[(1s,2s)-2-chloro-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-[(1s,2s)-2-chloro-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-[(1s,2s)-2-chloro-1-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-1-methyl-4-propylpyrrolidine-2-carboxamide
  • 21462-39-5 (hydrochloride)
  • 58207-19-5 (hydrochloride, monohydrate)
  • clinda & il-12
  • clindamycin & crl8131
  • clindamycin & interleukin 12
  • clindamycin & vrc3375
  • cly
  • dalacine
  • l-threo-.alpha.-d-galacto-octopyranoside, methyl 7-chloro-6,7,8-trideoxy-6-[[[(2s,4r)-1-methyl-4-propyl-2-pyrrolidinyl]carbonyl]amino]-1-thio-
  • methyl 7-chloro-6,7,8-trideoxy-6-{[(4r)-1-methyl-4-propyl-l-prolyl]amino}-1-thio-l-threo-alpha-d-galacto-octopyranoside
InChIKey KDLRVYVGXIQJDK-AWPVFWJPSA-N
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