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AG01CC46

1485692-21-4 | Dolutegravir O-β-D-glucuronide

Chemical structure of Dolutegravir O-β-D-glucuronide, CAS 1485692-21-4
AG01CC46
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CAS Number 1485692-21-4
Catalog Number AG01CC46(AGN-PC-0WBNZO)
Chemical Name Dolutegravir O-β-D-glucuronide
IUPAC Name (1S,2R,3S,4R,5R)-5-[[(3S,7R)-13-[(2,4-difluorophenyl)methylcarbamoyl]-7-methyl-9,12-dioxo-4-oxa-1,8-diazatricyclo[8.4.0.03,8]tetradeca-10,13-dien-11-yl]oxy]-2,3,4-trihydroxycyclohexane-1-carboxylic acid
InChI InChI=1S/C27H29F2N3O10/c1-11-4-5-41-18-10-31-9-15(25(37)30-8-12-2-3-13(28)6-16(12)29)21(34)24(19(31)26(38)32(11)18)42-17-7-14(27(39)40)20(33)23(36)22(17)35/h2-3,6,9,11,14,17-18,20,22-23,33,35-36H,4-5,7-8,10H2,1H3,(H,30,37)(H,39,40)/t11-,14+,17-,18+,20-,22+,23+/m1/s1
InChI Key SSPCEQPHKUWNFL-HSSNMISVSA-N
Molecular Formula C26H27F2N3O11
Molecular Weight 595.5029
SMILES FC(C=C(C=C1)F)=C1CNC(C(C2=O)=CN(C[C@@]3([H])N([C@@H](CCO3)C)C4=O)C4=C2O[C@@H]5O[C@@H]([C@H]([C@@H]([C@H]5O)O)O)C(O)=O)=O
Synonyms
M3 of dolutegravir, Dolutegravir o-beta-D-glucuronide, 1485692-21-4, UNII-JAW8NTAVN5 component SSPCEQPHKUWNFL-HSSNMISVSA-N, beta-D-Glucopyranosiduronic acid, (4R,12alphaS)-9-((((2,4-difluorophenyl)methyl)amino)carbonyl)-3,4,6,8,12,12alpha-hexahydro-4-methyl-6,8-dioxo-2H-pyrido(1'2':4,5)pyrazino(2,1-beta)(1,3)oxazin-7-yl, JAW8NTAVN5, UNII-JAW8NTAVN5,

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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