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3-(3S-Hydroxy-2R,4S,10R-tm-14S-(2,2,4-tm-1,3-dioxolan-4-yl)-1-oxo-11-boxy-9R-bomethoxy-7-pentadecenyl)-4-methyl-5-phenyl

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3-(3S-Hydroxy-2R,4S,10R-tm-14S-(2,2,4-tm-1,3-dioxolan-4-yl)-1-oxo-11-boxy-9R-bomethoxy-7-pentadecenyl)-4-methyl-5-phenyl
SpectraBase Compound ID 4HV1x07RIry
InChI InChI=1S/C49H67NO9/c1-34(44(51)37(4)46(52)50-38(5)45(58-47(50)53)41-25-16-11-17-26-41)20-18-19-27-42(56-33-54-30-39-21-12-9-13-22-39)36(3)43(55-31-40-23-14-10-15-24-40)29-28-35(2)49(8)32-57-48(6,7)59-49/h9-17,19,21-27,34-38,42-45,51H,18,20,28-33H2,1-8H3/b27-19-
InChIKey QWPSDEXFDGCKHT-DIBXZPPDSA-N
Mol Weight 814.1 g/mol
Molecular Formula C49H67NO9
Exact Mass 813.481583 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 57sv6Ytig18
Name 3-(3S-Hydroxy-2R,4S,10R-tm-14S-(2,2,4-tm-1,3-dioxolan-4-yl)-1-oxo-11-boxy-9R-bomethoxy-7-pentadecenyl)-4-methyl-5-phenyl
Comments TM: TRIMETHYL, BOXY: BENZYLOXY, BOMETHOXY: BENZYLOXYMETHOXY
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C49H67NO9
InChI InChI=1S/C49H67NO9/c1-34(44(51)37(4)46(52)50-38(5)45(58-47(50)53)41-25-16-11-17-26-41)20-18-19-27-42(56-33-54-30-39-21-12-9-13-22-39)36(3)43(55-31-40-23-14-10-15-24-40)29-28-35(2)49(8)32-57-48(6,7)59-49/h9-17,19,21-27,34-38,42-45,51H,18,20,28-33H2,1-8H3/b27-19-
InChIKey QWPSDEXFDGCKHT-DIBXZPPDSA-N
Literature Reference D.A. Evans, S.L. Bender, J. Morris, J. Am. Chem. Soc. 110, 2506 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3