(5R,6R,9S,13R)-5,13-Diethyl-9-Methyl-14-Oxoazacyclotetradecan-6-Yl 3-Amino-3,6-Dideoxy-α-L-Talopyranoside

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Formula C24H46N2O5
IUPAC Name (3r,7s,10r,11r)-10-[(2r,3r,4r,5s,6s)-4-amino-3,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-3,11-diethyl-7-methyl-azacyclotetradecan-2-one
Molecular Mass 442.632 g·mol−1
Heat of Formation -1281.5 ± 16.7 kJ·mol−1
Dipole Moment 4.02 ± 1.08 D
Volume 581.27 Å 3
Surface Area 412.15 Å 2
HOMO Energy -9.49 ± 0.55 eV
LUMO Energy 1.48 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,7s,10r,11r)-10-[(2r,3r,4r,5s,6s)-4-amino-3,5-dihydroxy-6-methyl-oxan-2-yl]oxy-3,11-diethyl-7-methyl-1-azacyclotetradecan-2-one
  • (3r,7s,10r,11r)-10-[(2r,3r,4r,5s,6s)-4-amino-3,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-3,11-diethyl-7-methyl-1-azacyclotetradecan-2-one
  • (3r,7s,10r,11r)-10-[(2r,3r,4r,5s,6s)-4-amino-3,5-dihydroxy-6-methyloxan-2-yl]oxy-3,11-diethyl-7-methyl-1-azacyclotetradecan-2-one
  • (3r,7s,10r,11r)-10-[[(2r,3r,4r,5s,6s)-4-amino-3,5-dihydroxy-6-methyl-2-tetrahydropyranyl]oxy]-3,11-diethyl-7-methyl-1-azacyclotetradecan-2-one
  • azacyclotetradecan-2-one, 10-((3-amino-3,6-dideoxy-alpha-l-talopyranosyl)oxy)-3,11-diethyl-7-methyl-, (3r-(3r*,7s*,10r*,11r*))-
  • sch 38516
CAS Number(s)
  • 128563-23-5
InChIKey MJDWUOZLTDXLJL-PEFIXUBVSA-N
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