(2S,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-[2-[4-[3-[2-(Trifluoromethyl)Phenothiazin-10-Yl]Propyl]Piperazin-1-Yl]Ethoxy]Oxane-2-Carboxylic Acid
[CAS# 133310-09-5]

Identification

• Name: (2S,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-[2-[4-[3-[2-(Trifluoromethyl)Phenothiazin-10-Yl]Propyl]Piperazin-1-Yl]Ethoxy]Oxane-2-Carboxylic Acid
• Synonyms: (2S,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-[2-[4-[3-[2-(Trifluoromethyl)Phenothiazin-10-Yl]Propyl]Piperazin-1-Yl]Ethoxy]Tetrahydropyran-2-Carboxylic Acid; (2S,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-[2-[4-[3-[2-(Trifluoromethyl)-10-Phenothiazinyl]Propyl]-1-Piperazinyl]Ethoxy]-2-Tetrahydropyrancarboxylic Acid; 7-Hfpgl
• Molecular Formula: C₂₈H₃₄F₃N₃O₇S
• Molecular Weight: 613.65
• CAS Registry Number: 133310-09-5
• SMILES: [C@H]5(OCCN1CCN(CC1)CCCN2C4=C(SC3=CC=C(C=C23)C(F)(F)F)C=CC=C4)[C@H](O)[C@@H](O)[C@H](O)[C@H](O5)C(=O)O
• InChI: 1S/C28H34F3N3O7S/c29-28(30,31)17-6-7-21-19(16-17)34(18-4-1-2-5-20(18)42-21)9-3-8-32-10-12-33(13-11-32)14-15-40-27-24(37)22(35)23(36)25(41-27)26(38)39/h1-2,4-7,16,22-25,27,35-37H,3,8-15H2,(H,38,39)/t22-,23-,24+,25-,27+/m0/s1
• InChIKey: FPAXYGQWHAIDFV-GAYSTUHSSA-N

Properties

• Density: 1.529g/cm³ (Cal.)
• Boiling point: 778.897°C at 760 mmHg (Cal.)
• Flash point: 424.862°C (Cal.)