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#9;2,2'-[[5,11,17,23-TETRAKIS-(1,1-DIMETHYLETHYL)-26,28-DIHYDROXYPENTACYClO-[19.3.1.1(3,7).1(9,13).1(15,19)]-OCTACOSA-1(25),3,5,7(28),9,11,13(27),15,17,19(
SpectraBase Compound ID mYdTgYHCyK
InChI InChI=1S/C50H64O8/c1-47(2,3)37-19-29-15-33-23-39(49(7,8)9)25-35(45(33)57-27-41(51)52)17-31-21-38(48(4,5)6)22-32(44(31)56-14)18-36-26-40(50(10,11)12)24-34(46(36)58-28-42(53)54)16-30(20-37)43(29)55-13/h19-26H,15-18,27-28H2,1-14H3,(H,51,52)(H,53,54)
InChIKey GRSQCGICFHAMOA-UHFFFAOYSA-N
Mol Weight 793.1 g/mol
Molecular Formula C50H64O8
Exact Mass 792.460119 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7lZKtJQIXWp
Name #9;2,2'-[[5,11,17,23-TETRAKIS-(1,1-DIMETHYLETHYL)-26,28-DIHYDROXYPENTACYClO-[19.3.1.1(3,7).1(9,13).1(15,19)]-OCTACOSA-1(25),3,5,7(28),9,11,13(27),15,17,19(
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C50H64O8
InChI InChI=1S/C50H64O8/c1-47(2,3)37-19-29-15-33-23-39(49(7,8)9)25-35(45(33)57-27-41(51)52)17-31-21-38(48(4,5)6)22-32(44(31)56-14)18-36-26-40(50(10,11)12)24-34(46(36)58-28-42(53)54)16-30(20-37)43(29)55-13/h19-26H,15-18,27-28H2,1-14H3,(H,51,52)(H,53,54)
InChIKey GRSQCGICFHAMOA-UHFFFAOYSA-N
Literature Reference Author R.OSTASZEWSKI,T.W.STEVENS,W.VERBOOM,D.N.REINHOUDT,F.M.KASPER SEN
Literature Reference Citation REC.TR.CH.P.-B.,110,294(1991)
Literature Reference DOI 10.1002/recl.19911100608
Molecular Weight 793.053 g/mol
Solvent CDCl3
Source File Reference UWCS21182