(2S,3S,4R,5R,6S)-3-[(Z)-1-[4-(2-Dimethylaminoethoxy)Phenyl]-2-Phenylbut-1-Enyl]-3,4,5-Trihydroxy-6-(Phenoxy)Oxane-2-Carboxylic Acid
[CAS# 128255-45-8]

Identification

• Name: (2S,3S,4R,5R,6S)-3-[(Z)-1-[4-(2-Dimethylaminoethoxy)Phenyl]-2-Phenylbut-1-Enyl]-3,4,5-Trihydroxy-6-(Phenoxy)Oxane-2-Carboxylic Acid
• Synonyms: (2S,3S,4R,5R,6S)-3-[(Z)-1-[4-(2-Dimethylaminoethoxy)Phenyl]-2-Phenyl-But-1-Enyl]-3,4,5-Trihydroxy-6-(Phenoxy)Tetrahydropyran-2-Carboxylic Acid; (2S,3S,4R,5R,6S)-3-[(Z)-1-[4-(2-Dimethylaminoethoxy)Phenyl]-2-Phenylbut-1-Enyl]-3,4,5-Trihydroxy-6-(Phenoxy)-2-Tetrahydropyrancarboxylic Acid; (2S,3S,4R,5R,6S)-3-[(Z)-1-[4-(2-Dimethylaminoethoxy)Phenyl]-2-Phenyl-But-1-Enyl]-3,4,5-Trihydroxy-6-(Phenoxy)Oxane-2-Carboxylic Acid
• Molecular Formula: C₃₂H₃₇NO₈
• Molecular Weight: 563.65
• CAS Registry Number: 128255-45-8
• SMILES: [C@@]4(O)(\C(=C(C1=CC=CC=C1)\CC)C2=CC=C(OCCN(C)C)C=C2)[C@H](O[C@@H](OC3=CC=CC=C3)[C@H](O)[C@H]4O)C(=O)O
• InChI: 1S/C32H37NO8/c1-4-25(21-11-7-5-8-12-21)26(22-15-17-23(18-16-22)39-20-19-33(2)3)32(38)28(35)27(34)31(41-29(32)30(36)37)40-24-13-9-6-10-14-24/h5-18,27-29,31,34-35,38H,4,19-20H2,1-3H3,(H,36,37)/b26-25-/t27-,28-,29-,31-,32+/m1/s1
• InChIKey: SVFHAYXIYPCIFK-DKNZORBSSA-N

Properties

• Density: 1.298g/cm³ (Cal.)
• Boiling point: 745.219°C at 760 mmHg (Cal.)
• Flash point: 404.494°C (Cal.)