Isohomohalichondrin B
[CAS# 157078-48-3]

Identification

• Name: Isohomohalichondrin B
• Synonyms: Nsc650467; Ihb Cpd; Nci60_017561
• Molecular Formula: C₆₁H₈₆O₁₉
• Molecular Weight: 1123.34
• CAS Registry Number: 157078-48-3
• SMILES: O1C%11C%12OC2C%13OC1(C2)CCC3OC(C(C3)=C)CCC%15OC(CC%10OC9C(OC8C(OC7(OC6C(OC5(OC4C(OC(C(O)C4)CC(=O)CCO)C(C5)C)CC6C)C7)C8)C9)C(C%10OC(=O)CC%14OC%11C(OC%12%13)CC%14)C)C(C(C%15)C)=C
• InChI: 1S/C61H86O19/c1-27-15-34-7-9-38-28(2)16-36(66-38)11-13-59-25-47-55(79-59)56-57(73-47)58(80-59)54-39(70-56)10-8-35(68-54)18-49(65)74-53-32(6)52-44(69-43(53)20-40(67-34)31(27)5)21-42-46(72-52)24-61(75-42)26-48-51(78-61)30(4)23-60(77-48)22-29(3)50-45(76-60)19-37(64)41(71-50)17-33(63)12-14-62/h27,29-30,32,34-48,50-58,62,64H,2,5,7-26H2,1,3-4,6H3
• InChIKey: WVWWZNXKZNACRW-UHFFFAOYSA-N

Properties

• Density: 1.374g/cm³ (Cal.)