Sodium carminate
[CAS# 64536-02-3]

Identification

• Name: Sodium carminate
• Synonyms: Sodium 3,5,6,8-Tetrahydroxy-1-Methyl-9,10-Dioxo-7-[(2S,3R,4R,5S)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Anthracene-2-Carboxylate; Sodium 3,5,6,8-Tetrahydroxy-1-Methyl-9,10-Dioxo-7-[(2S,3R,4R,5S)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]-2-Anthracenecarboxylate; Sodium 3,5,6,8-Tetrahydroxy-9,10-Diketo-1-Methyl-7-[(2S,3R,4R,5S)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Anthracene-2-Carboxylate
• Molecular Formula: C₂₂H₁₉NaO₁₃
• Molecular Weight: 514.37
• CAS Registry Number: 64536-02-3
• SMILES: [C@H]1(OC([C@@H](O)[C@H](O)[C@H]1O)CO)C4=C(O)C2=C(C(=O)C3=C(C2=O)C(=C(C(=C3)O)C([O-])=O)C)C(=C4O)O.[Na+]
• InChI: 1S/C22H20O13.Na/c1-4-8-5(2-6(24)9(4)22(33)34)13(25)10-11(15(8)27)16(28)12(18(30)17(10)29)21-20(32)19(31)14(26)7(3-23)35-21;/h2,7,14,19-21,23-24,26,28-32H,3H2,1H3,(H,33,34);/q;+1/p-1/t7?,14-,19+,20-,21+;/m1./s1
• InChIKey: WTQDFYCCGXPQPN-AEXMGWOMSA-M