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  6. 5Beta/6Beta-Hydroxy Lurasidone Hydrochloride(Mixture of Diastereomers), TRC

5Beta/6Beta-Hydroxy Lurasidone Hydrochloride(Mixture of Diastereomers), TRC

Product Code. 30400172
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Product Code. 30400172 Supplier Toronto Research Chemicals Supplier No. TRCH9439101MG

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Description

High-purity organic molecules and analytical standards, strategically delivered worldwide to empower innovation and commercial success.

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Specifications

Chemical Name or Material 5beta/6beta-Hydroxy Lurasidone Hydrochloride(Mixture of Diastereomers)
Analyte or Component Names 5beta/6beta-Hydroxy Lurasidone Hydrochloride(Mixture of Diastereomers)
Shipping Condition Room Temperature
Molecular Formula C28H37ClN4O3S
Synonym [2(1R*,2R*),3aα,4β,(5/6)β,7β,7aα]-2-[[2-[[4-(1,2-Benzisothiazol-3-yl)-1-piperazinyl]methyl]cyclohexyl]methyl]hexahydro-(5/6)-hydroxy-4,7-methano-1H-isoindole-1,3(2H)-dione Hydrochloride, Lurasidone Metabolite M-8 Hydrochloride
InChI Formula InChI=1S/2C28H36N4O3S.2ClH/c2*33-22-14-19-13-21(22)25-24(19)27(34)32(28(25)35)16-18-6-2-1-5-17(18)15-30-9-11-31(12-10-30)26-20-7-3-4-8-23(20)36-29-26;;/h2*3-4,7-8,17-19,21-22,24-25,33H,1-2,5-6,9-16H2;2*1H/t17-,18-,19+,21-,22-,24+,25-;17-,18-,19-,21+,22+,24-,25+;;/m00../s1
Solution Type Neat
SMILES [H][C@]([C@@]1([H])C2=O)([C@@]3([H])[C@H](O)C[C@]1([H])C3)C(N2C[C@@H]4CCCC[C@H]4CN5CCN(C6=NSC7=C6C=CC=C7)CC5)=O.[H][C@]([C@@]8([H])C9=O)([C@@]%10([H])C[C@H](O)[C@]8([H])C%10)C(N9C[C@@H]%11CCCC[C@H]%11CN%12CCN(C%13=NSC%14=C%13C=CC=C%14)CC%12)=O.Cl.Cl
IUPAC Name (3aR,4S,5R,7S,7aS)-2-(((1R,2R)-2-((4-(benzo[d]isothiazol-3-yl)piperazin-1-yl)methyl)cyclohexyl)methyl)-5-hydroxyhexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione--(3aS,4R,5S,7R,7aR)-2-(((1R,2R)-2-((4-(benzo[d]isothiazol-3-yl)piperazin-1-yl)methyl)cyclohexyl)methyl)-5-hydroxyhexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione (1/1) dihydrochloride
Industry Type Pharmaceutical
Molecular Weight (g/mol) 545.14
Quantity 1 mg
Formula Weight 544.23
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