Calcium Bis[(R)-2-[(2,4-Dihydroxy-3,3-Dimethyl-1-Oxobutyl)Amino]Ethane-1-Sulphonate]
[CAS# 68921-90-4]

Identification

• Name: Calcium Bis[(R)-2-[(2,4-Dihydroxy-3,3-Dimethyl-1-Oxobutyl)Amino]Ethane-1-Sulphonate]
• Synonyms: Calcium 2-[(4-Hydroxy-3,3-Dimethyl-2-Oxido-Butanoyl)Amino]Ethanesulfonate; Calcium 2-[(4-Hydroxy-3,3-Dimethyl-2-Oxido-1-Oxobutyl)Amino]Ethanesulfonate; Ethanesulfonic Acid, 2-(((2R)-2,4-Dihydroxy-3,3-Dimethyl-1-Oxobutyl)Amino)-, Calcium Salt
• Molecular Formula: C₈H₁₅CaNO₆S
• Molecular Weight: 293.35
• CAS Registry Number: 68921-90-4 (2545-84-8)
• EINECS: 272-966-3
• SMILES: C([S]([O-])(=O)=O)CNC(=O)C([O-])C(CO)(C)C.[Ca++]
• InChI: 1S/C8H16NO6S.Ca/c1-8(2,5-10)6(11)7(12)9-3-4-16(13,14)15;/h6,10H,3-5H2,1-2H3,(H,9,12)(H,13,14,15);/q-1;+2/p-1
• InChIKey: RENGJRCTESDCSY-UHFFFAOYSA-M