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    Also known as: 1335210-34-8, (4r,12as)-7-methoxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2h-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxylic acid, Mfcd28978321, Schembl15084338, Amy30024, Zinc150055997
    Molecular Formula
    C14H16N2O6
    Molecular Weight
    308.29  g/mol
    InChI Key
    KGWJKKUSXSBPSK-APPZFPTMSA-N
    CAS 1335210-34-8
    1 2D Structure

    CAS 1335210-34-8

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (3S,7R)-11-methoxy-7-methyl-9,12-dioxo-4-oxa-1,8-diazatricyclo[8.4.0.03,8]tetradeca-10,13-diene-13-carboxylic acid
    2.1.2 InChI
    InChI=1S/C14H16N2O6/c1-7-3-4-22-9-6-15-5-8(14(19)20)11(17)12(21-2)10(15)13(18)16(7)9/h5,7,9H,3-4,6H2,1-2H3,(H,19,20)/t7-,9+/m1/s1
    2.1.3 InChI Key
    KGWJKKUSXSBPSK-APPZFPTMSA-N
    2.1.4 Canonical SMILES
    CC1CCOC2N1C(=O)C3=C(C(=O)C(=CN3C2)C(=O)O)OC
    2.1.5 Isomeric SMILES
    C[C@@H]1CCO[C@@H]2N1C(=O)C3=C(C(=O)C(=CN3C2)C(=O)O)OC
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 1335210-34-8

    2. (4r,12as)-7-methoxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2h-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxylic Acid

    3. Mfcd28978321

    4. Schembl15084338

    5. Amy30024

    6. Zinc150055997

    7. Ac-30856

    8. F11521

    9. (4r,12as)-7-methoxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2h-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]-oxazine-9-carboxylic Acid

    10. (4r,12as)-7-methoxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2h-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxylicacid

    11. (4r,12as)-7-methoxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2h-pyrido[1',2';4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxylic Acid

    2.3 Create Date
    2015-02-13
    3 Chemical and Physical Properties
    Molecular Weight 308.29 g/mol
    Molecular Formula C14H16N2O6
    XLogP30.8
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count7
    Rotatable Bond Count2
    Exact Mass308.10083623 g/mol
    Monoisotopic Mass308.10083623 g/mol
    Topological Polar Surface Area96.4 Ų
    Heavy Atom Count22
    Formal Charge0
    Complexity623
    Isotope Atom Count0
    Defined Atom Stereocenter Count2
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1

    BUILDING BLOCK

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    Almelo

    India
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    (4R,12aS)-7-Methoxy-4-Methyl- 6,8-Dioxo-3,4,6,8,12...

    CAS Number : CAS-1335210-34-8

    End Use API :

    End Use API : Dolutegravir Sodium

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    Guangdong Raffles PharmaTech Co Ltd

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    (4R,12aS)-7-Methoxy-4-methyl-6,8-dioxo-3,4,6,8,12,...

    CAS Number : 1335210-34-8

    End Use API :

    End Use API : Dolutegravir Sodium

    About the Company : Established in August 2011, Raffles PharmaTech is a high-tech enterprise that focus on development, manufacturing and sales of high-value added active pharmaceutical ingredients and int...

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    Shenzhen HwaGen Pharmaceutical

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    (4R,12aS)-7-Methoxy-4-methyl-6,8-dioxo-3,4,6,8,12,...

    CAS Number : 1335210-34-8

    End Use API :

    End Use API : Dolutegravir Sodium

    About the Company : Shenzhen HwaGen Pharmaceutical Co., Ltd. (HwaGen Pharma) was founded in December of 2015 under the leadership of a “National 1000 Talents Program” expert. By leveraging its core com...

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    Dolutegravir Sodium

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