(3R,4S,7R,11S)-11-Ethyl-3,7-Dimethyl-2-Oxoazacyclotetradecan-4-Yl 3-Amino-3,6-Dideoxy-α-L-Talopyranoside

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Properties Simple | Detailed

Formula C23H44N2O5
IUPAC Name (3r,4s,7r,11s)-4-[(2r,3r,4r,5s,6s)-4-amino-3,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-11-ethyl-3,7-dimethyl-azacyclotetradecan-2-one
Molecular Mass 428.606 g·mol−1
Heat of Formation -1237.5 ± 16.7 kJ·mol−1
Dipole Moment 6.06 ± 1.08 D
Volume 561.01 Å 3
Surface Area 439.03 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy 1.47 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,4s,7r,11s)-4-[(2r,3r,4r,5s,6s)-4-amino-3,5-dihydroxy-6-methyl-oxan-2-yl]oxy-11-ethyl-3,7-dimethyl-1-azacyclotetradecan-2-one
  • (3r,4s,7r,11s)-4-[(2r,3r,4r,5s,6s)-4-amino-3,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-11-ethyl-3,7-dimethyl-1-azacyclotetradecan-2-one
  • (3r,4s,7r,11s)-4-[(2r,3r,4r,5s,6s)-4-amino-3,5-dihydroxy-6-methyloxan-2-yl]oxy-11-ethyl-3,7-dimethyl-1-azacyclotetradecan-2-one
  • (3r,4s,7r,11s)-4-[[(2r,3r,4r,5s,6s)-4-amino-3,5-dihydroxy-6-methyl-2-tetrahydropyranyl]oxy]-11-ethyl-3,7-dimethyl-1-azacyclotetradecan-2-one
  • 3-((3-amino-3,6-dideoxy-alpha-l-talopyranosyl)oxy)-2,6-dimethyl-10-ethyl-13-tridecanelactam
  • azacyclotetradecan-2-one, 4-((3-amino-3,6-dideoxy-alpha-l-talopyranosyl)oxy)-11-ethyl-3,7-dimethyl-, (3r-(3r*,4s*,7r*,11s*))-
  • fluvirucin a1
CAS Number(s)
  • 137019-37-5
InChIKey ZRJBXPCQRSLIKK-BDPAYSQHSA-N
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