(R)-N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-beta-Alanine calcium salt (2:1) mixt. with 4-amino-N-(5-methoxy-2-pyrimidinyl)benzenesulfonamide monosilver salt
[CAS# 123774-77-6]

Identification

• Name: (R)-N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-beta-Alanine calcium salt (2:1) mixt. with 4-amino-N-(5-methoxy-2-pyrimidinyl)benzenesulfonamide monosilver salt
• Synonyms: Calcium; Silver; (4-Aminophenyl)Sulfonyl-(5-Methoxypyrimidin-2-Yl)Azanide; 3-[(2,4-Dihydroxy-3,3-Dimethyl-Butanoyl)Amino]Propanoate; Calcium; Silver
• Molecular Formula: C₂₉H₄₃AgCaN₆O₁₃S
• Molecular Weight: 863.70
• CAS Registry Number: 123774-77-6
• SMILES: N(C(=O)C(O)C(CO)(C)C)CCC([O-])=O.C2=C([S](=O)(=O)[N-]C1=NC=C(OC)C=N1)C=CC(=C2)N.[O-]C(=O)CCNC(=O)C(O)C(CO)(C)C.[Ca++].[Ag+]
• InChI: 1S/C11H11N4O3S.2C9H17NO5.Ag.Ca/c1-18-9-6-13-11(14-7-9)15-19(16,17)10-4-2-8(12)3-5-10;2*1-9(2,5-11)7(14)8(15)10-4-3-6(12)13;;/h2-7H,12H2,1H3;2*7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13);;/q-1;;;+1;+2/p-2
• InChIKey: JIATYBYHEXWFRC-UHFFFAOYSA-L

Properties

• Boiling point: 539.4°C at 760 mmHg (Cal.)
• Flash point: 280°C (Cal.)