(2S)-2-Amino-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxyphenyl]Propanoic Acid
[CAS# 38292-17-0]

Identification

• Name: (2S)-2-Amino-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxyphenyl]Propanoic Acid
• Synonyms: (2S)-2-Amino-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxyphenyl]Propanoic Acid; (2S)-2-Amino-3-[4-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]Phenyl]Propanoic Acid; (2S)-2-Amino-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxyphenyl]Propionic Acid
• Molecular Formula: C₁₅H₂₁NO₈
• Molecular Weight: 343.33
• CAS Registry Number: 38292-17-0
• SMILES: [C@@H]1([C@@H]([C@@H](O)[C@@H]([C@H](O1)CO)O)O)OC2=CC=C(C[C@@H](C(=O)O)N)C=C2
• InChI: 1S/C15H21NO8/c16-9(14(21)22)5-7-1-3-8(4-2-7)23-15-13(20)12(19)11(18)10(6-17)24-15/h1-4,9-13,15,17-20H,5-6,16H2,(H,21,22)/t9-,10+,11+,12-,13+,15+/m0/s1
• InChIKey: JZAFZYMRELRTKL-MYMCGMNMSA-N

Properties

• Density: 1.529g/cm³ (Cal.)
• Boiling point: 629.611°C at 760 mmHg (Cal.)
• Flash point: 334.577°C (Cal.)