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(2S)-2-methoxy-2-(2-naphthyl)acetic acid [(E,1S,2S)-9-[(2R)-6-(methoxymethoxy)-2,8-dimethyl-chroman-2-yl]-1-[(1R)-1-(methoxymethoxy)-3-methyl-but-2-enyl]-2,6-dimethyl-non-6-enyl] ester
SpectraBase Compound ID 4kvKIqxUtQ0
InChI InChI=1S/C44H60O8/c1-30(2)24-39(50-29-47-8)41(51-43(45)42(48-9)36-20-19-34-17-10-11-18-35(34)26-36)32(4)16-12-14-31(3)15-13-22-44(6)23-21-37-27-38(49-28-46-7)25-33(5)40(37)52-44/h10-11,15,17-20,24-27,32,39,41-42H,12-14,16,21-23,28-29H2,1-9H3/b31-15+/t32-,39+,41-,42-,44+/m0/s1
InChIKey YAEXVYLRTPFEIQ-GQJYIGABSA-N
Mol Weight 717.0 g/mol
Molecular Formula C44H60O8
Exact Mass 716.428819 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9fHJ5StDUb2
Name (2S)-2-methoxy-2-(2-naphthyl)acetic acid [(E,1S,2S)-9-[(2R)-6-(methoxymethoxy)-2,8-dimethyl-chroman-2-yl]-1-[(1R)-1-(methoxymethoxy)-3-methyl-but-2-enyl]-2,6-dimethyl-non-6-enyl] ester
Compound Number (S)-#8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H60O8
InChI InChI=1S/C44H60O8/c1-30(2)24-39(50-29-47-8)41(51-43(45)42(48-9)36-20-19-34-17-10-11-18-35(34)26-36)32(4)16-12-14-31(3)15-13-22-44(6)23-21-37-27-38(49-28-46-7)25-33(5)40(37)52-44/h10-11,15,17-20,24-27,32,39,41-42H,12-14,16,21-23,28-29H2,1-9H3/b31-15+/t32-,39+,41-,42-,44+/m0/s1
InChIKey YAEXVYLRTPFEIQ-GQJYIGABSA-N
Literature Reference Author M.IWASHIMA,N.TAKO,T.HAYAKAWA,T.MATSUNAGA,J.MORI,H.SAITO
Literature Reference Citation CHEM.PHARM.BULL.,56,124(2008)
Literature Reference DOI 10.1248/cpb.56.124
Molecular Weight 716.956 g/mol
Sample ID 1235
Solvent CDCl3