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FIUUOACGZVMQQW-MWKQOIESSA-N

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FIUUOACGZVMQQW-MWKQOIESSA-N
SpectraBase Compound ID AsszxWKHmvE
InChI InChI=1S/C42H38O12/c1-51-39-19-25(7-13-33(39)45)5-11-29(43)23-37(49)31(17-27-9-15-35(47)41(21-27)53-3)32(18-28-10-16-36(48)42(22-28)54-4)38(50)24-30(44)12-6-26-8-14-34(46)40(20-26)52-2/h5-24,45-50H,1-4H3/b11-5+,12-6+,31-17-,32-18-,37-23-,38-24-
InChIKey FIUUOACGZVMQQW-MWKQOIESSA-N
Mol Weight 734.8 g/mol
Molecular Formula C42H38O12
Exact Mass 734.236327 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dktti9tRPKQ
Name FIUUOACGZVMQQW-MWKQOIESSA-N
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H38O12
InChI InChI=1S/C42H38O12/c1-51-39-19-25(7-13-33(39)45)5-11-29(43)23-37(49)31(17-27-9-15-35(47)41(21-27)53-3)32(18-28-10-16-36(48)42(22-28)54-4)38(50)24-30(44)12-6-26-8-14-34(46)40(20-26)52-2/h5-24,45-50H,1-4H3/b11-5+,12-6+,31-17-,32-18-,37-23-,38-24-
InChIKey FIUUOACGZVMQQW-MWKQOIESSA-N
Literature Reference Author S.M.S.CHAUHAN,A.S.KANDADAI,N.JAIN,A.KUMAR
Literature Reference Citation CHEM.PHARM.BULL.,51,1345(2003)
Literature Reference DOI 10.1248/cpb.51.1345
Molecular Weight 734.757 g/mol
Solvent DMSO-D6
Source File Reference UWLU20519