Calcium 4-phosphopantothenate

Molecular Formula: C9H16CaNO8P


InChI: InChI=1/C9H18NO8P.Ca/c1-9(2,5-18-19(15,16)17)7(13)8(14)10-4-3-6(11)12;/h7,13H,3-5H2,1-2H3,(H,10,14)(H,11,12)(H2,15,16,17);/q;+2/p-2/t7-;/m0./s1/fC9H16NO8P.Ca/h10,15H;/q-2;m

InChIKey: InChIKey=GQSFAKGGGXTCJK-MLPLGWHEDE
SMILES: CC(C)(COP(=O)(O)[O-])C(C(=O)NCCC(=O)[O-])O.[Ca+2]

Names:
    beta-Alanine, N-(2-hydroxy-3,3-dimethyl-1-oxo-4-(phosphonoxy)butyl)-, calcium salt (1:1), (R)-
    beta-ALANINE, N-(2-HYDROXY-3,3-DIMETHYL-1-OXO-4-(PHOSPHONOXY)BUTYL)-, CALCIUM SA
    calcium 3-[[(2R)-2-hydroxy-4-(hydroxy-oxido-phosphoryl)oxy-3,3-dimethyl-butanoyl]amino]propanoate
    Calcium 4-phosphopantothenate
    55816-28-9

Registries:
    PubChem CID 41634
    PubChem ID 182331