Hupehensis saponin E
[CAS# 152464-76-1]

Identification

• Name: Hupehensis saponin E
• Synonyms: [6-[[3,4-Dihydroxy-6-(Hydroxymethyl)-5-(3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-Tetrahydropyran-2-Yl]Oxymethyl]-3,4,5-Trihydroxy-Tetrahydropyran-2-Yl] 10-[3-[4-[3,5-Dihydroxy-4-[3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Oxy-3,5-Dihydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-4,5-Dihydroxy-Tetrahydropyran-2-Yl]Oxy-9-(Hydroxymethyl)-2,2,6A,6B,9,12A-Hexamethyl-1,3,4,5,6,6A,7,8,8A,10,11,12,13,14B-Tetradecahydropicene-4A-Carboxylate; 10-[[3-[[4-[[3,5-Dihydroxy-4-[[3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-2-Tetrahydropyranyl]Oxy]-3,5-Dihydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-4,5-Dihydroxy-2-Tetrahydropyranyl]Oxy]-9-(Hydroxymethyl)-2,2,6A,6B,9,12A-Hexamethyl-1,3,4,5,6,6A,7,8,8A,10,11,12,13,14B-Tetradecahydropicene-4A-Carboxylic Acid [6-[[3,4-Dihydroxy-6-(Hydroxymethyl)-5-[(3,4,5-Trihydroxy-6-Methyl-2-Tetrahydropyranyl)Oxy]-2-Tetrahydropyranyl]Oxymethyl]-3,4,5-Trihydroxy-2-Tetrahydropyranyl] Ester; 10-[3-[4-[3,5-Dihydroxy-4-(3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl)Oxy-Tetrahydropyran-2-Yl]Oxy-3,5-Dihydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-4,5-Dihydroxy-Tetrahydropyran-2-Yl]Oxy-2,2,6A,6B,9,12A-Hexamethyl-9-Methylol-1,3,4,5,6,6A,7,8,8A,10,11,12,13,14B-Tetradecahydropicene-4A-Carboxylic Acid [6-[[3,4-Dihydroxy-6-Methylol-5-(3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-Tetrahydropyran-2-Yl]Oxymethyl]-3,4,5-Trihydroxy-Tetrahydropyran-2-Yl] Ester
• Molecular Formula: C₇₀H₁₁₄O₃₅
• Molecular Weight: 1515.65
• CAS Registry Number: 152464-76-1
• SMILES: C(OC1C(C(O)C(C(O1)CO)OC2C(C(O)C(C(O2)C)O)O)O)C%12C(O)C(C(C(OC(C%10%11CCC4(C(=CCC5C3(CCC(C(C3CCC45C)(CO)C)OC9C(OC8C(C(OC7C(C(OC6C(C(O)C(C(O6)CO)O)O)C(CO7)O)O)C(C(O8)C)O)O)C(O)C(CO9)O)C)C%10CC(C)(C)CC%11)C)=O)O%12)O)O
• InChI: 1S/C70H114O35/c1-26-38(76)43(81)47(85)59(95-26)102-54-33(21-72)98-57(50(88)46(54)84)94-24-34-42(80)45(83)49(87)61(99-34)105-64(91)70-17-15-65(3,4)19-29(70)28-9-10-36-66(5)13-12-37(67(6,25-73)35(66)11-14-69(36,8)68(28,7)16-18-70)100-63-56(40(78)30(74)22-93-63)104-62-52(90)55(39(77)27(2)96-62)103-58-51(89)53(31(75)23-92-58)101-60-48(86)44(82)41(79)32(20-71)97-60/h9,26-27,29-63,71-90H,10-25H2,1-8H3
• InChIKey: DNDOZBDUEDTZGE-UHFFFAOYSA-N

Properties

• Density: 1.561g/cm³ (Cal.)