4-Methylumbelliferyl-Galactosyl(1-3)-N-Acetylgalactosaminide
[CAS# 82358-93-8]

Identification

• Name: 4-Methylumbelliferyl-Galactosyl(1-3)-N-Acetylgalactosaminide
• Synonyms: N-[(2S,3R,4R,5R,6R)-5-Hydroxy-6-(Hydroxymethyl)-2-(4-Methyl-2-Oxo-Chromen-7-Yl)Oxy-4-[(2R,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-3-Yl]Acetamide; N-[(2S,3R,4R,5R,6R)-5-Hydroxy-6-(Hydroxymethyl)-2-[(4-Methyl-2-Oxo-7-Chromenyl)Oxy]-4-[[(2R,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-3-Tetrahydropyranyl]Acetamide; N-[(2S,3R,4R,5R,6R)-5-Hydroxy-2-(2-Keto-4-Methyl-Chromen-7-Yl)Oxy-6-Methylol-4-[(2R,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-3-Yl]Acetamide
• Molecular Formula: C₂₄H₃₁NO₁₃
• Molecular Weight: 541.51
• CAS Registry Number: 82358-93-8
• SMILES: [C@H]3(OC1=CC2=C(C=C1)C(=CC(O2)=O)C)[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)NC(C)=O
• InChI: 1S/C24H31NO13/c1-9-5-16(29)35-13-6-11(3-4-12(9)13)34-23-17(25-10(2)28)22(19(31)15(8-27)36-23)38-24-21(33)20(32)18(30)14(7-26)37-24/h3-6,14-15,17-24,26-27,30-33H,7-8H2,1-2H3,(H,25,28)/t14-,15-,17-,18+,19+,20+,21-,22-,23-,24+/m1/s1
• InChIKey: VSWQTQWBDDXHMJ-AYWUTESRSA-N

Properties

• Density: 1.588g/cm³ (Cal.)
• Boiling point: 910.127°C at 760 mmHg (Cal.)
• Flash point: 504.227°C (Cal.)