Chemical Component Summary

Name(3R,4S,5S)-4-(acetylamino)-5-amino-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylic acid
Synonymsstereomutated oseltamivir carboxylate
Identifiers(3R,4S,5S)-4-acetamido-5-azanyl-3-pentan-3-yloxy-cyclohexene-1-carboxylic acid
FormulaC14 H24 N2 O4
Molecular Weight284.351
TypeNON-POLYMER
Isomeric SMILESCCC(CC)O[C@@H]1C=C(C[C@@H]([C@@H]1NC(=O)C)N)C(=O)O
InChIInChI=1S/C14H24N2O4/c1-4-10(5-2)20-12-7-9(14(18)19)6-11(15)13(12)16-8(3)17/h7,10-13H,4-6,15H2,1-3H3,(H,16,17)(H,18,19)/t11-,12+,13-/m0/s1
InChIKeyNENPYTRHICXVCS-XQQFMLRXSA-N

Chemical Details

Formal Charge0
Atom Count44
Chiral Atom Count3
Bond Count44
Aromatic Bond Count0

Related Resource References

Resource NameReference
PubChem 40640966, 40640967