N-(Tris((beta-Galactopyranosyloxy)Methyl)Methyl)-N(alpha)-(4-(5-Cholesten-3beta-Yloxy)Succinyl)Glycinamide
[CAS# 91202-79-8]

Identification

• Name: N-(Tris((beta-Galactopyranosyloxy)Methyl)Methyl)-N(alpha)-(4-(5-Cholesten-3beta-Yloxy)Succinyl)Glycinamide
• Synonyms: [(3S,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-Dimethylhexyl]-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] 4-Oxo-4-[[2-Oxo-2-[[2-[(2R,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-1,1-Bis[[
• Molecular Formula: C₅₅H₉₂N₂O₂₂
• Molecular Weight: 1133.33
• CAS Registry Number: 91202-79-8
• SMILES: [C@H]67[C@H]1[C@@H]([C@@]5(C(=CC1)C[C@@H](OC(=O)CCC(=O)NCC(=O)NC(CO[C@@H]2O[C@@H]([C@H](O)[C@H](O)[C@H]2O)CO)(CO[C@@H]3O[C@@H]([C@H](O)[C@H](O)[C@H]3O)CO)CO[C@@H]4O[C@@H]([C@H](O)[C@H](O)[C@H]4O)CO)CC5)C)CC[C@@]6([C@H](CC7)[C@@H](CCCC(C)C)C)C
• InChI: 1S/C55H92N2O22/c1-27(2)7-6-8-28(3)32-11-12-33-31-10-9-29-19-30(15-17-53(29,4)34(31)16-18-54(32,33)5)76-40(63)14-13-38(61)56-20-39(62)57-55(24-73-50-47(70)44(67)41(64)35(21-58)77-50,25-74-51-48(71)45(68)42(65)36(22-59)78-51)26-75-52-49(72)46(69)43(66)37(23
• InChIKey: ISCFDVIOYCQTEH-SXQGXBMZSA-N

Properties

• Density: 1.404g/cm³ (Cal.)
• Boiling point: 1256.909°C at 760 mmHg (Cal.)
• Flash point: 713.953°C (Cal.)