6-[6-[5-Acetamido-2-(Hydroxymethyl)-6-[(3,4,5,6-Tetrahydroxyoxan-2-Yl)Methoxy]-3-[3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxyoxan-4-Yl]Oxy-4-Acetyloxy-5-Hydroxy-2-Methyloxan-3-Yl]Oxy-3,4,5-Trihydroxyoxane-2-Carboxylic Acid
[CAS# 130815-82-6]

Identification

• Name: 6-[6-[5-Acetamido-2-(Hydroxymethyl)-6-[(3,4,5,6-Tetrahydroxyoxan-2-Yl)Methoxy]-3-[3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxyoxan-4-Yl]Oxy-4-Acetyloxy-5-Hydroxy-2-Methyloxan-3-Yl]Oxy-3,4,5-Trihydroxyoxane-2-Carboxylic Acid
• Synonyms: 6-[6-[5-Acetamido-2-(Hydroxymethyl)-6-[(3,4,5,6-Tetrahydroxytetrahydropyran-2-Yl)Methoxy]-3-[3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-4-Yl]Oxy-4-Acetoxy-5-Hydroxy-2-Methyl-Tetrahydropyran-3-Yl]Oxy-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylic Acid; 6-[[6-[[5-Acetamido-2-(Hydroxymethyl)-6-[(3,4,5,6-Tetrahydroxy-2-Tetrahydropyranyl)Methoxy]-3-[[3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-4-Tetrahydropyranyl]Oxy]-4-Acetoxy-5-Hydroxy-2-Methyl-3-Tetrahydropyranyl]Oxy]-3,4,5-Trihydroxy-2-Tetrahydropyrancarboxylic Acid; 6-[6-[5-Acetamido-2-Methylol-6-[(3,4,5,6-Tetrahydroxytetrahydropyran-2-Yl)Methoxy]-3-(3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl)Oxy-Tetrahydropyran-4-Yl]Oxy-4-Acetoxy-5-Hydroxy-2-Methyl-Tetrahydropyran-3-Yl]Oxy-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylic Acid
• Molecular Formula: C₃₄H₅₅NO₂₇
• Molecular Weight: 909.80
• CAS Registry Number: 130815-82-6
• SMILES: C(C1C(C(C(C(O1)OC3C(OC(OCC2C(C(C(C(O2)O)O)O)O)C(C3OC5C(O)C(C(OC4C(O)C(O)C(O)C(O4)C(O)=O)C(O5)C)OC(C)=O)NC(C)=O)CO)O)O)O)O
• InChI: 1S/C34H55NO27/c1-7-24(59-33-22(48)18(44)19(45)28(62-33)29(50)51)27(55-9(3)39)23(49)34(54-7)61-26-13(35-8(2)38)31(53-6-12-15(41)16(42)20(46)30(52)56-12)58-11(5-37)25(26)60-32-21(47)17(43)14(40)10(4-36)57-32/h7,10-28,30-34,36-37,40-49,52H,4-6H2,1-3H3,(H,35,38)(H,50,51)
• InChIKey: XKFBVTGNPULLMG-UHFFFAOYSA-N

Properties

• Density: 1.743g/cm³ (Cal.)
• Boiling point: 1190.975°C at 760 mmHg (Cal.)
• Flash point: 674.077°C (Cal.)