Aliskiren

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Formula C30H53N3O6
IUPAC Name (2s,4s,5s,7s)-5-amino-n-(3-amino-2,2-dimethyl-3-oxo-propyl)-4-hydroxy-2-isopropyl-7-[[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl]-8-methyl-nonanamide
Molecular Mass 551.758 g·mol−1
Heat of Formation -1283.5 ± 16.7 kJ·mol−1
Dipole Moment 7.00 ± 1.08 D
Volume 723.43 Å 3
Surface Area 597.11 Å 2
HOMO Energy -8.20 ± 0.55 eV
LUMO Energy 3.36 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,4s,5s,7s)-5-amino-n-(3-amino-2,2-dimethyl-3-oxo-propyl)-4-hydroxy-2-isopropyl-7-[[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl]-8-methyl-nonanamide
  • (2s,4s,5s,7s)-5-amino-n-(3-amino-2,2-dimethyl-3-oxo-propyl)-4-hydroxy-7-[[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl]-8-methyl-2-propan-2-yl-nonanamide
  • (2s,4s,5s,7s)-5-amino-n-(3-amino-2,2-dimethyl-3-oxopropyl)-4-hydroxy-2-isopropyl-7-[[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl]-8-methylnonanamide
  • (2s,4s,5s,7s)-5-amino-n-(3-amino-2,2-dimethyl-3-oxopropyl)-4-hydroxy-7-[[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl]-8-methyl-2-propan-2-ylnonanamide
  • (2s,4s,5s,7s)-5-amino-n-(3-amino-3-keto-2,2-dimethyl-propyl)-4-hydroxy-2-isopropyl-7-[4-methoxy-3-(3-methoxypropoxy)benzyl]-8-methyl-pelargonamide
  • aliskiren (usan)
  • d03208
CAS Number(s)
  • 173334-57-1
InChIKey UXOWGYHJODZGMF-QORCZRPOSA-N
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