Sarasinoside C1
[CAS# 114066-51-2]

Identification

• Name: Sarasinoside C1
• Synonyms: N-[2-[5-[3-Acetamido-4,5-Dihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-2-[[17-(1,5-Dimethyl-3-Oxo-Hex-4-Enyl)-4,4,10,13-Tetramethyl-1,2,3,5,6,7,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-3-Yl]Oxy]-4-Hydroxy-Tetrahydropyran-3-Yl]Oxy-4,5-Dihydroxy-6-[(3,4,5-Trihydroxytetrahydropyran-2-Yl)Oxymethyl]Tetrahydropyran-3-Yl]Acetamide; N-[2-[[5-[[3-Acetamido-4,5-Dihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-2-[[17-(1,5-Dimethyl-3-Oxohex-4-Enyl)-4,4,10,13-Tetramethyl-1,2,3,5,6,7,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-3-Yl]Oxy]-4-Hydroxy-3-Tetrahydropyranyl]Oxy]-4,5-Dihydroxy-6-[(3,4,5-Trihydroxy-2-Tetrahydropyranyl)Oxymethyl]-3-Tetrahydropyranyl]Acetamide; N-[2-[5-(3-Acetamido-4,5-Dihydroxy-6-Methylol-Tetrahydropyran-2-Yl)Oxy-4-Hydroxy-2-[[17-(3-Keto-1,5-Dimethyl-Hex-4-Enyl)-4,4,10,13-Tetramethyl-1,2,3,5,6,7,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-3-Yl]Oxy]Tetrahydropyran-3-Yl]Oxy-4,5-Dihydroxy-6-[(3,4,5-Trihydroxytetrahydropyran-2-Yl)Oxymethyl]Tetrahydropyran-3-Yl]Acetamide
• Molecular Formula: C₅₅H₈₈N₂O₂₀
• Molecular Weight: 1097.30
• CAS Registry Number: 114066-51-2
• SMILES: C(OC1C(C(O)C(CO1)O)O)C8C(O)C(C(C(OC7C(OC5CCC4(C3=C(C2CCC(C2(CC3)C)C(CC(C=C(C)C)=O)C)CCC4C5(C)C)C)OCC(OC6C(C(O)C(C(O6)CO)O)NC(=O)C)C7O)O8)NC(=O)C)O
• InChI: 1S/C55H88N2O20/c1-24(2)18-28(61)19-25(3)30-11-12-31-29-10-13-37-53(6,7)38(15-17-55(37,9)32(29)14-16-54(30,31)8)76-52-48(44(66)36(23-72-52)75-49-39(56-26(4)59)45(67)42(64)34(20-58)73-49)77-50-40(57-27(5)60)46(68)43(65)35(74-50)22-71-51-47(69)41(63)33(62)21-70-51/h18,25,30-31,33-52,58,62-69H,10-17,19-23H2,1-9H3,(H,56,59)(H,57,60)
• InChIKey: WQPAMXVSIZMQQI-UHFFFAOYSA-N

Properties

• Density: 1.377g/cm³ (Cal.)
• Boiling point: 1202.433°C at 760 mmHg (Cal.)
• Flash point: 681.007°C (Cal.)