Peonidin
[CAS# 26838-13-1]

Identification

• Name: Peonidin
• Synonyms: (2R,3R,4S,5S,6R)-3-[3,5-Dihydroxy-2-(4-Hydroxy-3-Methoxy-Phenyl)Chromenylium-7-Yl]Oxy-6-(Hydroxymethyl)Tetrahydropyran-2,4,5-Triol Chloride; (2R,3R,4S,5S,6R)-3-[[3,5-Dihydroxy-2-(4-Hydroxy-3-Methoxyphenyl)-7-Chromenyliumyl]Oxy]-6-(Hydroxymethyl)Tetrahydropyran-2,4,5-Triol Chloride; (2R,3R,4S,5S,6R)-3-[[3,5-Dihydroxy-2-(4-Hydroxy-3-Methoxy-Phenyl)-1-Benzopyrylium-7-Yl]Oxy]-6-Methylol-Tetrahydropyran-2,4,5-Triol Chloride
• Molecular Formula: C₂₂H₂₃ClO₁₁
• Molecular Weight: 498.87
• CAS Registry Number: 26838-13-1
• SMILES: [O+]2=C(C(=CC3=C(O)C=C(O[C@@H]1[C@@H](O)[C@H](O)[C@H](O[C@H]1O)CO)C=C23)O)C4=CC(=C(O)C=C4)OC.[Cl-]
• InChI: 1S/C22H22O11.ClH/c1-30-16-4-9(2-3-12(16)24)20-14(26)7-11-13(25)5-10(6-15(11)32-20)31-21-19(28)18(27)17(8-23)33-22(21)29;/h2-7,17-19,21-23,27-29H,8H2,1H3,(H2-,24,25,26);1H/t17-,18-,19+,21-,22-;/m1./s1
• InChIKey: VGVGBJDJPKKXOF-UQMNZUSNSA-N