Aloe-emodin-3-(hydroxymethyl)-O-β-D-glucopyranoside
[CAS# 50488-89-6]

Identification

• Name: Aloe-emodin-3-(hydroxymethyl)-O-β-D-glucopyranoside
• Synonyms: W-O-b-D-Glucopyranosylaloeemodin; 1,8-dihydroxy-3-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-9,10-dihydroanthracene-9,10-dione
• Molecular Formula: C₂₁H₂₀O₁₀
• Molecular Weight: 432.38
• CAS Registry Number: 50488-89-6
• SMILES: C1=CC2=C(C(=C1)O)C(=O)C3=C(C=C(C=C3C2=O)COC4C(C(C(C(O4)CO)O)O)O)O
• InChI: 1S/C21H20O10/c22-6-13-17(26)19(28)20(29)21(31-13)30-7-8-4-10-15(12(24)5-8)18(27)14-9(16(10)25)2-1-3-11(14)23/h1-5,13,17,19-24,26,28-29H,6-7H2
• InChIKey: ASQHVCDULHERIH-UHFFFAOYSA-N

Properties

• solubility: Soluble in DMSO