Saquinavir mesilate CRS

Analytenname

Saquinavir mesilate

CAS-Nummer

149845-06-7

Molekularformel

C38 H50 N6 O5 . C H4 O3 S

Molekulargewicht

766.95

Genaue Masse

766.3724

Flammpunkt

5.0

SMILES

CC(C)(C)NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2CN1C[C@@H](O)[C@H](Cc3ccccc3)NC(=O)[C@H](CC(=O)N)NC(=O)c4ccc5ccccc5n4.CS(=O)(=O)O

InChI

1-5(2,3)4/h4-6,9-13,16-18,26-27,30-33,45H,7-8,14-15,19-23H2,1-3H3,(H2,39,46)(H,41,48)(H,42,47)(H,43,49), /m0./s1, InChI=1S/C38H50N6O5.CH4O3S/c1-38(2,3)43-37(49)32-20-26-14-7-8-15-27(26)22-44(32)23-33(45)30(19-24-11-5-4-6-12-24)41-36(48)31(21-34(39)46)42-35(47)29-18-17-25-13-9-10-16-28(25)40-29, 1H3,(H,2,3,4)/t26-,27+,30-,31-,32-,33+

IUPAC

(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;methanesulfonic acid

Abweichende CAS-Nummer

Free base: 127779-20-8

Lagertemperatur

2-8C Fridge/Coldroom

Versandtemperatur

Room Temperature

Herkunftsland

FRANCE

Tarif-Code

29334910

Produkttyp

API

Produktformat

Neat

API-Familie

Saquinavir Mesilate