1-(3,5-Dihydroxy-4-(3-(3-Hydroxy-4-Methoxyphenyl)-1-Oxopropyl)Phenoxy) -5,6-Dihydroxy-3-Hexanesulfonic Acid Monopotassium Salt
[CAS# 69873-10-5]

Identification

• Name: 1-(3,5-Dihydroxy-4-(3-(3-Hydroxy-4-Methoxyphenyl)-1-Oxopropyl)Phenoxy) -5,6-Dihydroxy-3-Hexanesulfonic Acid Monopotassium Salt
• Synonyms: Potassium 1-[3,5-Dihydroxy-4-[3-(3-Hydroxy-4-Methoxy-Phenyl)Propanoyl]Phenoxy]-5,6-Dihydroxy-Hexane-3-Sulfonate; Potassium 1-[3,5-Dihydroxy-4-[3-(3-Hydroxy-4-Methoxyphenyl)-1-Oxopropyl]Phenoxy]-5,6-Dihydroxyhexane-3-Sulfonate; 1-(3,5-Dihydroxy-4-(3-(3-Hydroxy-4-Methoxyphenyl)-1-Oxopropyl)Phenoxy)-5,6-Dihydroxy-3-Hexanesulfonic Acid Monopotassium Salt
• Molecular Formula: C₂₂H₂₇KO₁₁S
• Molecular Weight: 538.61
• CAS Registry Number: 69873-10-5
• SMILES: C1=C(OCCC([S]([O-])(=O)=O)CC(O)CO)C=C(O)C(=C1O)C(=O)CCC2=CC=C(OC)C(=C2)O.[K+]
• InChI: 1S/C22H28O11S.K/c1-32-21-5-3-13(8-18(21)26)2-4-17(25)22-19(27)10-15(11-20(22)28)33-7-6-16(34(29,30)31)9-14(24)12-23;/h3,5,8,10-11,14,16,23-24,26-28H,2,4,6-7,9,12H2,1H3,(H,29,30,31);/q;+1/p-1
• InChIKey: DUCYCLBRDPVUTO-UHFFFAOYSA-M