Rhein-8-glucoside calcium salt

• Catalog Number: ACM113443702
• CAS: 113443-70-2
• IUPAC Name: Calcium;3-carboxy-9,10-dioxo-5-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]anthracene-1,8-diolate
• Synonyms: Glucorhein
• Molecular Weight: 488.46
• Molecular Formula: C21H20CaO11
• Canonical SMILES: C1=CC(=C2C(=C1[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C(=O)C4=C(C2=O)C(=CC(=C4)C(=O)O)[O-])[O-].[Ca+2]
• InChI: InChI=1S/C21H18O11.Ca/c22-5-11-16(26)18(28)19(29)20(32-11)7-1-2-9(23)14-13(7)15(25)8-3-6(21(30)31)4-10(24)12(8)17(14)27;/h1-4,11,16,18-20,22-24,26,28-29H,5H2,(H,30,31);/q;+2/p-2/t11-,16-,18+,19-,20+;/m1./s1
• InChI Key: XXVBCAMVOFYHJP-WJGQHNSASA-L
• Purity: 98%
• Appearance: Powder
• Actives: 85%
• Physical State: Solid
• Typical Applications: Use as dispersing agent, emulsifying agent.; Use as pharmaceutical ingredient