Homohalichondrin B
[CAS# 101383-39-5]

Identification

• Name: Homohalichondrin B
• Synonyms: Neuro_000233; B7722121f049(=K053); From Marine Animal Axinella Sp.
• Molecular Formula: C₆₁H₈₆O₁₉
• Molecular Weight: 1123.34
• CAS Registry Number: 101383-39-5
• SMILES: O1C%12C%13OC2C%14OC1(C2)CCC3OC(C(C3)=C)CCC%16OC(CC%11OC%10C(OC9CC8(OC7C(OC6(OC5C(OC4C(OC(C4)C(O)CO)C5)C(C6)C)CC7C)C8)OC9C%10)C(C%11OC(=O)CC%15OC%12C(OC%13%14)CC%15)C)C(C(C%16)C)=C
• InChI: 1S/C61H86O19/c1-26-13-32-7-9-36-27(2)14-34(65-36)11-12-59-23-47-55(79-59)56-57(73-47)58(80-59)54-37(70-56)10-8-33(67-54)15-49(64)74-53-31(6)52-44(69-43(53)16-38(66-32)30(26)5)19-42-46(72-52)22-61(75-42)24-48-51(78-61)29(4)21-60(77-48)20-28(3)50-45(76-60)18-40-41(71-50)17-39(68-40)35(63)25-62/h26,28-29,31-48,50-58,62-63H,2,5,7-25H2,1,3-4,6H3
• InChIKey: LMZKVILFCFSDGK-UHFFFAOYSA-N

Properties

• Density: 1.388g/cm³ (Cal.)