Sarasinoside A1
[CAS# 114099-54-6]

Identification

• Name: Sarasinoside A1
• 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-6-[[4,5-Dihydroxy-6-(Hydroxymethyl)-3-[3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Oxymethyl]-4,5-Dihydroxy-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]-6-[[4,5-Dihydroxy-6-(Hydroxymethyl)-3-[[3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-2-Tetrahydropyranyl]Oxymethyl]-4,5-Dihydroxy-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-6-[[4,5-Dihydroxy-6-Methylol-3-(3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl)Oxy-Tetrahydropyran-2-Yl]Oxymethyl]-4,5-Dihydroxy-Tetrahydropyran-3-Yl]Acetamide
• Molecular Formula: C₆₂H₁₀₀N₂O₂₆
• Molecular Weight: 1289.47
• CAS Registry Number: 114099-54-6
• SMILES: C(OC1C(C(O)C(C(O1)CO)O)OC2C(C(O)C(C(O2)CO)O)O)C9C(O)C(C(C(OC8C(OC6CCC5(C4=C(C3CCC(C3(CC4)C)C(CC(C=C(C)C)=O)C)CCC5C6(C)C)C)OCC(OC7C(C(O)C(C(O7)CO)O)NC(=O)C)C8O)O9)NC(=O)C)O
• InChI: 1S/C62H100N2O26/c1-25(2)18-29(70)19-26(3)31-11-12-32-30-10-13-39-60(6,7)40(15-17-62(39,9)33(30)14-16-61(31,32)8)88-59-53(47(75)38(24-82-59)87-55-41(63-27(4)68)48(76)43(71)34(20-65)83-55)89-56-42(64-28(5)69)49(77)46(74)37(86-56)23-81-58-54(51(79)45(73)36(22-67)85-58)90-57-52(80)50(78)44(72)35(21-66)84-57/h18,26,31-32,34-59,65-67,71-80H,10-17,19-24H2,1-9H3,(H,63,68)(H,64,69)
• InChIKey: YMIDOMYJFRKBJR-UHFFFAOYSA-N

Properties

• Density: 1.445g/cm³ (Cal.)