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  • D-Pantothenic acid calcium salt hydrate

    • D-Pantothenic acid calcium salt hydrate

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    Catalog Number
    ACM331748073
    Product Name
    D-Pantothenic acid calcium salt hydrate
    Structure
    CAS
    331748-07-3
    Category
    Other Glass and Ceramic Materials
    IUPAC Name
    calcium;3-[[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]amino]propanoate;hydrate
    Molecular Weight
    494.5g/mol
    Molecular Formula
    C18H34CaN2O11
    Canonical SMILES
    CC(C)(CO)C(C(=O)NCCC(=O)[O-])O.CC(C)(CO)C(C(=O)NCCC(=O)[O-])O.O.[Ca+2]
    InChI
    InChI=1S/2C9H17NO5.Ca.H₂O/c2*1-9(2,5-11)7(14)8(15)10-4-3-6(12)13;;/h2*7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13);;1H2/q;;+2;/p-2/t2*7-;;/m00../s1
    InChI Key
    KUKRZUPDYACRAM-GXIDORRSSA-L
    Complexity
    534
    Covalently-Bonded Unit Count
    4
    EC Number
    205-278-9
    Exact Mass
    494.178851g/mol
    Formal Charge
    0
    Heavy Atom Count
    32
    Monoisotopic Mass
    494.178851g/mol
    Rotatable Bond Count
    14
    MSDS
    Download MSDS
    COA
    Download COA
    Spec Sheet
    Download Spec Sheet
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