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#8;(-)-(1R,6R)-6-HYDROXY-4-[[(4R,6S)-6-[(2S)-4-[(4-METHOXYBENZOYL)-OXY]-2-HYDROXYBUTYL]-2,2-DIMETHYL-1,3-DIOXAN-4-YL]-METHYL]-CYCLOHEPT-3-EN-1-YL-METHOXYBENZOA

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#8;(-)-(1R,6R)-6-HYDROXY-4-[[(4R,6S)-6-[(2S)-4-[(4-METHOXYBENZOYL)-OXY]-2-HYDROXYBUTYL]-2,2-DIMETHYL-1,3-DIOXAN-4-YL]-METHYL]-CYCLOHEPT-3-EN-1-YL-METHOXYBENZOA
SpectraBase Compound ID SWcZw6kBKq
InChI InChI=1S/C34H44O10/c1-34(2)43-30(21-31(44-34)19-25(35)15-16-41-32(37)23-6-11-27(39-3)12-7-23)18-22-5-10-29(20-26(36)17-22)42-33(38)24-8-13-28(40-4)14-9-24/h5-9,11-14,25-26,29-31,35-36H,10,15-21H2,1-4H3/t25-,26+,29+,30+,31+/m0/s1
InChIKey AVBAIPKDXJJENY-VVGNYVCESA-N
Mol Weight 612.7 g/mol
Molecular Formula C34H44O10
Exact Mass 612.293448 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LiHcFDHs2CH
Name #8;(-)-(1R,6R)-6-HYDROXY-4-[[(4R,6S)-6-[(2S)-4-[(4-METHOXYBENZOYL)-OXY]-2-HYDROXYBUTYL]-2,2-DIMETHYL-1,3-DIOXAN-4-YL]-METHYL]-CYCLOHEPT-3-EN-1-YL-METHOXYBENZOA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H44O10
InChI InChI=1S/C34H44O10/c1-34(2)43-30(21-31(44-34)19-25(35)15-16-41-32(37)23-6-11-27(39-3)12-7-23)18-22-5-10-29(20-26(36)17-22)42-33(38)24-8-13-28(40-4)14-9-24/h5-9,11-14,25-26,29-31,35-36H,10,15-21H2,1-4H3/t25-,26+,29+,30+,31+/m0/s1
InChIKey AVBAIPKDXJJENY-VVGNYVCESA-N
Literature Reference Author M.E.SCHWENTER,P.VOGEL
Literature Reference Citation J.ORG.CHEM.,66,7869(2001)
Literature Reference DOI 10.1021/jo010172u
Molecular Weight 612.717 g/mol
Solvent CDCl3
Source File Reference UWVN24212