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AG009CDC

1350462-55-3 | MK 5172 hydrate

Chemical structure of MK 5172 hydrate, CAS 1350462-55-3
AG009CDC
sdsSDS
sdsCOA

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CAS Number 1350462-55-3
Catalog Number AG009CDC
Chemical Name MK 5172 hydrate
IUPAC Name (1R,18R,20R,24S,27S)-24-tert-butyl-N-[(1R,2S)-1-(cyclopropylsulfonylcarbamoyl)-2-ethenylcyclopropyl]-7-methoxy-22,25-dioxo-2,21-dioxa-4,11,23,26-tetrazapentacyclo[24.2.1.03,12.05,10.018,20]nonacosa-3,5(10),6,8,11-pentaene-27-carboxamide;hydrate
InChI InChI=1S/C38H50N6O9S.H2O/c1-6-22-19-38(22,35(47)43-54(49,50)25-13-14-25)42-32(45)29-18-24-20-44(29)34(46)31(37(2,3)4)41-36(48)53-30-16-21(30)10-8-7-9-11-27-33(52-24)40-28-17-23(51-5)12-15-26(28)39-27;/h6,12,15,17,21-22,24-25,29-31H,1,7-11,13-14,16,18-20H2,2-5H3,(H,41,48)(H,42,45)(H,43,47);1H2/t21-,22-,24-,29+,30-,31-,38-;/m1./s1
InChI Key RXSARIJMSJWJLZ-CIAYNJNFSA-N
MDL Number MFCD31561045
Molecular Formula C38H52N6O10S
Molecular Weight 784.9187
SMILES COC1=CC=C2C(N=C(O[C@]3([H])C[C@@H]([C@@](N[C@@]6([C@@](NS(C7CC7)(=O)=O)=O)[C@H](C=C)C6)=O)N5C3)C(CCCCC[C@H]4[C@H](OC(N[C@@H]([C@](C)(C)C)C5=O)=O)C4)=N2)=C1.[H]O[H]
UNII 4O2AB118LA
Synonyms
grazoprevir, grazoprevir anhydrous, grazoprevir monohydrate, MK 5172, MK-5172, MK5172, Grazoprevir hydrate, MK-5172 (hydrate), UNII-4O2AB118LA, Grazoprevir [USAN], 1350462-55-3, MK-5172 hydrate, 4O2AB118LA, Grazoprevir (USAN), MK 5172, Grazyna (TN), Grazoprevir monohydrate, Grazoprevir hydrate (JAN), CHEMBL3039533, SCHEMBL18259662, DTXSID00159229, HY-15298B, AKOS030526434, CS-1376, D10639, W-6089, Grazoprevir hydrate;MK5172 hydrate;MK 5172 hydrate, (1aR,5S,8S,10R,22aR)-N-((1R,2S)-1-((cyclopropylsulfonyl)carbamoyl)-2-ethenylcyclopropyl)-5-(1,1-dimethylethyl)-14-methoxy-3,6-dioxo-1,1a,3,4,5,6,9,10,18,19,20,21,22,22a-tetradecahydro-8H-7,10-methanocyclopropa(18,19)(1,10,3,6)dioxadiazacyclononadecino(11,12-b)quinoxaline-8-carboxamide hydrate, Cyclopropanecarboxamide, N-((((1R,2R)-2-(5-(3-hydroxy-6-methoxy-2-quinoxalinyl)pentyl)cyclopropyl)oxy)carbonyl)-3-methyl-L-valyl-(4R)-4-hydroxy-L-prolyl-1-amino-N-(cyclopropylsulfonyl)-2-ethenyl-, cyclic (1->2)-ether, hydrate (1 :1) (1R,2S)-, Grazoprevir, MK-5172,

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    CERTIFICATE OF ANALYSIS
    Chemical Name: Batch Number:
    Chemical Structure: CAS Registry No:
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    Conclusion: The above product meets the specifications of Angene.
    Analyst:Chase
    Date:
    Reviewed by:Jessie
    Date:
    Angene International Limited