Saquinavir (127779-20-8)

General informations

Last verification the 07/11/2013

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Identification

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Numero CAS

127779-20-8

Nom scientifique (FR)

Saquinavir

Nom scientifique (EN)

(2S)-N-[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-3-hydroxy-1-phenylbutan-2-yl]-2-(quinoline-2-carbonylamino)butanediamide

Autres dénominations scientifiques (Autre langues)

(1E,2S)-2-[(2-Chinolinylcarbonyl)amino]-N1-{(2S,3R)-3-hydroxy-4-[(3S,4aS,8aS)-3-{(Z)-hydroxy[(2-methyl-2-propanyl)imino]methyl}octahydro-2(1H)-isochinolinyl]-1-phenyl-2-butanyl}butandiimidsäure ; (1E,2S)-N1-{(2S,3R)-3-Hydroxy-4-[(3S,4aS,8aS)-3-{(Z)-hydroxy[(2-methyl-2-propanyl)imino]methyl}octahydro-2(1H)-isoquinolinyl]-1-phenyl-2-butanyl}-2-[(2-quinolinylcarbonyl)amino]butanediimidic acid ; Butanediamide, N1-((1S,2R)-3-((3S,4aS,8aS)-3-(((1,1-dimethylethyl)amino)carbonyl)octahydro-2(1H)-isoquinolinyl)-2-hydroxy-1-(phenylmethyl)propyl)-2-((2-quinolinylcarbonyl)amino)-, (2S)- ; Butanediimidic acid, N1-[(1S,2R)-3-[(3S,4aS,8aS)-3-[(Z)-[(1,1-dimethylethyl)imino]hydroxymethyl]octahydro-2(1H)-isoquinolinyl]-2-hydroxy-1-(phenylmethyl)propyl]-2-[(2-quinolinylcarbonyl)amino]-, (1E ,2S)- ; L-Aspartamide, N1-[(1S,2R)-3-[(3S,4aS,8aS)-3-[[(1,1-dimethylethyl)amino]carbonyl]octahydro-2(1H)-isoquinolinyl]-2-hydroxy-1-(phenylmethyl)propyl]-N2-(2-quinolinylcarbonyl)- ; N1-{(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)octahydroisoquinolin-2(1H)-yl]-3-hydroxy-1-phenylbutan-2-yl}-N2-(quinolin-2-ylcarbonyl)-L-aspartamide ; N-tert-Butyldecahydro-2-[2(R)-hydroxy-4-phenyl-3(S)-[[N-(2-quinolylcarbonyl)-L-asparaginyl]amino]butyl](4aS,8aS)-isoquinoline-3(S)-carboxamide

Code EC

Code SANDRE

Number CIPAC

Formule chimique brute

\(\ce{ C38H50N6O5 }\)

Code InChlKey

QWAXKHKRTORLEM-UGJKXSETSA-N

Code SMILES

CC(C)(C)NC(=O)C2CC1CCCCC1CN2CC(O)C(Cc3ccccc3)NC(=O)C(CC(N)=O)NC(=O)c5ccc4ccccc4n5

Behavior

Last verification the 07/11/2013

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Bioaccumulation

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Aquatic organisms

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Organismes aquatiques
ineris name	Specie	Value	Trofic level	Taxon	Matrix	Life stage	Effect	Detailed effect	Duration of exposure	ineris method	Guideline	Commentary	Source
Bioaccumulation BCF		12.41 -								Calcul			EPA

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Bibliography

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