28-O-Glucopyranosyl-(1-6)-glucopyranosyl 3-O-rhamnopyranosyl-(1-2)-arabinopyranosyl-30-norolean-12,20(29)-dien-28-oic acid
[CAS# 125239-12-5]

Identification

• Name: 28-O-Glucopyranosyl-(1-6)-glucopyranosyl 3-O-rhamnopyranosyl-(1-2)-arabinopyranosyl-30-norolean-12,20(29)-dien-28-oic acid
• Synonyms: [3,4,6-Trihydroxy-5-[[3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxymethyl]Tetrahydropyran-2-Yl] 10-[4,5-Dihydroxy-3-(3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-Tetrahydropyran-2-Yl]Oxy-6A,6B,9,9,12A-Pentamethyl-2-Methylene-1,3,4,5,6,6A,7,8,8A,10,11,12,13,14B-Tetradecahydropicene-4A-Carboxylate; 10-[[4,5-Dihydroxy-3-[(3,4,5-Trihydroxy-6-Methyl-2-Tetrahydropyranyl)Oxy]-2-Tetrahydropyranyl]Oxy]-6A,6B,9,9,12A-Pentamethyl-2-Methylene-1,3,4,5,6,6A,7,8,8A,10,11,12,13,14B-Tetradecahydropicene-4A-Carboxylic Acid [3,4,6-Trihydroxy-5-[[3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxymethyl]-2-Tetrahydropyranyl] Ester; 10-[4,5-Dihydroxy-3-(3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-Tetrahydropyran-2-Yl]Oxy-6A,6B,9,9,12A-Pentamethyl-2-Methylene-1,3,4,5,6,6A,7,8,8A,10,11,12,13,14B-Tetradecahydropicene-4A-Carboxylic Acid [3,4,6-Trihydroxy-5-[(3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl)Oxymethyl]Tetrahydropyran-2-Yl] Ester
• Molecular Formula: C₅₂H₈₂O₂₁
• Molecular Weight: 1043.21
• CAS Registry Number: 125239-12-5
• SMILES: C(OC1OC(C(O)C(O)C1O)CO)C9C(O)C(O)C(OC(=O)C38C(C2=CCC4C(C2(CC3)C)(CCC7C4(CCC(OC5OCC(O)C(O)C5OC6OC(C(O)C(O)C6O)C)C7(C)C)C)C)CC(CC8)=C)OC9O
• InChI: 1S/C52H82O21/c1-22-10-15-52(47(65)73-45-38(61)33(56)24(42(64)72-45)20-66-43-39(62)37(60)35(58)28(19-53)69-43)17-16-50(6)25(26(52)18-22)8-9-30-49(5)13-12-31(48(3,4)29(49)11-14-51(30,50)7)70-46-41(34(57)27(54)21-67-46)71-44-40(63)36(59)32(55)23(2)68-44/h8,23-24,26-46,53-64H,1,9-21H2,2-7H3
• InChIKey: XBURTOCWRDWUSK-UHFFFAOYSA-N

Properties

• Density: 1.456g/cm³ (Cal.)