Calotroposide B
[CAS# 146714-00-3]

Identification

• Name: Calotroposide B
• Synonyms: [17-Acetyl-8,14,17-Trihydroxy-3-[5-[5-[5-[5-(5-Hydroxy-4-Methoxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-4-Methoxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-4-Methoxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-4-Methoxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-4-Methoxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-10,13-Dimethyl-1,2,3,4,7,9,11,12,15,16-Decahydrocyclopenta[A]Phenanthren-12-Yl] Benzoate; Benzoic Acid [17-Acetyl-8,14,17-Trihydroxy-3-[[5-[[5-[[5-[[5-[(5-Hydroxy-4-Methoxy-6-Methyl-2-Tetrahydropyranyl)Oxy]-4-Methoxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-4-Methoxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-4-Methoxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-4-Methoxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-10,13-Dimethyl-1,2,3,4,7,9,11,12,15,16-Decahydrocyclopenta[A]Phenanthren-12-Yl] Ester; Benzoic Acid [17-Acetyl-8,14,17-Trihydroxy-3-[5-[5-[5-[5-(5-Hydroxy-4-Methoxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-4-Methoxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-4-Methoxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-4-Methoxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-4-Methoxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-10,13-Dimethyl-1,2,3,4,7,9,11,12,15,16-Decahydrocyclopenta[A]Phenanthren-12-Yl] Ester
• Molecular Formula: C₆₃H₉₆O₂₂
• Molecular Weight: 1205.44
• CAS Registry Number: 146714-00-3
• SMILES: C1=CC=CC=C1C(OC3C%10(C(C2(CC=C9C(C2C3)(CCC(OC8OC(C(OC7OC(C(OC6OC(C(OC5OC(C(OC4OC(C(O)C(C4)OC)C)C(C5)OC)C)C(C6)OC)C)C(C7)OC)C)C(C8)OC)C)C9)C)O)(CCC%10(C(=O)C)O)O)C)=O
• InChI: 1S/C63H96O22/c1-32-53(65)41(70-9)26-49(75-32)82-55-34(3)77-51(28-43(55)72-11)84-57-36(5)79-52(30-45(57)74-13)85-56-35(4)78-50(29-44(56)73-12)83-54-33(2)76-48(27-42(54)71-10)80-40-20-21-59(7)39(25-40)19-22-62(68)46(59)31-47(81-58(66)38-17-15-14-16-18-38)60(8)61(67,37(6)64)23-24-63(60,62)69/h14-19,32-36,40-57,65,67-69H,20-31H2,1-13H3
• InChIKey: NOUHJGOURCZSGH-UHFFFAOYSA-N

Properties

• Density: 1.304g/cm³ (Cal.)