Pteroside
[CAS# 62043-50-9]

Identification

• Name: Pteroside
• Synonyms: (2S,3S)-3-Hydroxy-7-(Hydroxymethyl)-2,5-Dimethyl-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxyethyl]Indan-1-One; (2S,3S)-3-Hydroxy-7-(Hydroxymethyl)-2,5-Dimethyl-6-[2-[[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]Ethyl]-1-Indanone; (2S,3S)-3-Hydroxy-2,5-Dimethyl-7-Methylol-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxyethyl]Indan-1-One
• Molecular Formula: C₂₀H₂₈O₉
• Molecular Weight: 412.44
• CAS Registry Number: 62043-50-9
• SMILES: [C@@H]3(O)C1=C(C(=C(C(=C1)C)CCO[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)CO)CO)C(=O)[C@H]3C
• InChI: 1S/C20H28O9/c1-8-5-11-14(16(24)9(2)15(11)23)12(6-21)10(8)3-4-28-20-19(27)18(26)17(25)13(7-22)29-20/h5,9,13,15,17-23,25-27H,3-4,6-7H2,1-2H3/t9-,13+,15-,17+,18-,19+,20+/m0/s1
• InChIKey: QUCQWGWEDCGWFJ-NLKQLHMRSA-N

Properties

• Density: 1.487g/cm³ (Cal.)
• Boiling point: 713.117°C at 760 mmHg (Cal.)
• Flash point: 251.461°C (Cal.)