COMPOUND RECORD :


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Summary

Compound Information

FormulaC87H81B3O6
Molecular Weight1255.003
SynonymsNot available

Structure Descriptors

SMILES:CC1=CC(C)=C(C(C)=C1)C1=CC2=C3C(=C1)C1=CC(=CC4=C1C1=C3C3=C5C6=C(C=C(C=C6C6=C3C2=CC(=C6)B2OC(C)(C)C(C)(C)O2)C2=C(C)C=C(C)C=C2C)C2=C3C(=CC(=C2)B2OC(C)(C)C(C)(C)O2)C2=C(C4=CC(=C2)C2=C(C)C=C(C)C=C2C)C1=C53)B1OC(C)(C)C(C)(C)O1
InChI:1S/C87H81B3O6/c1-40-22-43(4)67(44(5)23-40)49-28-55-61-34-52(88-91-82(10,11)83(12,13)92-88)36-63-57-30-50(68-45(6)24-41(2)25-46(68)7)32-59-65-38-54(90-95-86(18,19)87(20,21)96-90)39-66-60-33-51(69-47(8)26-42(3)27-48(69)9)31-58-64-37-53(89-93-84(14,15)85(16,17)94-89)35-62-56(29-49)70(55)76-79(73(61)63)77(71(57)59)81(75(65)66)78(72(58)60)80(76)74(62)64/h22-39H,1-21H3
InChIKey:FMBWKSJBYWNDIY-UHFFFAOYSA-N