(2S)-2-Amino-3-[(3S,4S,5S,6R)-4,5-Dihydroxy-6-(Hydroxymethyl)-3-[(3S,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxyoxan-2-Yl]Oxypropanoic Acid
[CAS# 145452-14-8]

Identification

• Name: (2S)-2-Amino-3-[(3S,4S,5S,6R)-4,5-Dihydroxy-6-(Hydroxymethyl)-3-[(3S,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxyoxan-2-Yl]Oxypropanoic Acid
• Synonyms: (2S)-2-Amino-3-[(3S,4S,5S,6R)-4,5-Dihydroxy-6-(Hydroxymethyl)-3-[(3S,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Oxy-Propanoic Acid; (2S)-2-Amino-3-[[(3S,4S,5S,6R)-4,5-Dihydroxy-6-(Hydroxymethyl)-3-[[(3S,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-2-Tetrahydropyranyl]Oxy]Propanoic Acid; (2S)-2-Amino-3-[(3S,4S,5S,6R)-4,5-Dihydroxy-6-Methylol-3-[(3S,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Oxy-Propionic Acid
• Molecular Formula: C₁₅H₂₇NO₁₃
• Molecular Weight: 429.38
• CAS Registry Number: 145452-14-8
• SMILES: [C@H](C(=O)O)(N)COC2[C@@H](OC1[C@@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO)[C@@H](O)[C@H](O)[C@H](O2)CO
• InChI: 1S/C15H27NO13/c16-4(13(24)25)3-26-15-12(10(22)8(20)6(2-18)28-15)29-14-11(23)9(21)7(19)5(1-17)27-14/h4-12,14-15,17-23H,1-3,16H2,(H,24,25)/t4-,5+,6+,7+,8+,9-,10-,11-,12-,14?,15?/m0/s1
• InChIKey: FHFACMITEBPXDJ-CJWUELSBSA-N

Properties

• Density: 1.723g/cm³ (Cal.)
• Boiling point: 798.537°C at 760 mmHg (Cal.)
• Flash point: 436.74°C (Cal.)