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7b,9a,10b-Triacetoxy-2a-(A-methyl-butyryloxy)-4(20),11-taxadien-5a-ol
SpectraBase Compound ID AeK9sfN9RoR
InChI InChI=1S/C31H46O9/c1-11-15(2)29(36)40-26-21-13-12-16(3)24(30(21,8)9)27(38-19(6)33)28(39-20(7)34)31(10)23(37-18(5)32)14-22(35)17(4)25(26)31/h15,21-23,25-28,35H,4,11-14H2,1-3,5-10H3
InChIKey RIHLIEZPEMBSOA-UHFFFAOYSA-N
Mol Weight 562.7 g/mol
Molecular Formula C31H46O9
Exact Mass 562.314183 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9s6eUbbM823
Name 7b,9a,10b-Triacetoxy-2a-(A-methyl-butyryloxy)-4(20),11-taxadien-5a-ol
Comments C18 ALPHA, C19 BETA REASSIGNED (A.H.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C31H46O9
InChI InChI=1S/C31H46O9/c1-11-15(2)29(36)40-26-21-13-12-16(3)24(30(21,8)9)27(38-19(6)33)28(39-20(7)34)31(10)23(37-18(5)32)14-22(35)17(4)25(26)31/h15,21-23,25-28,35H,4,11-14H2,1-3,5-10H3
InChIKey RIHLIEZPEMBSOA-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference D. De Marcano, B. Mendez, A.C. Rojas, Org. Magn. Resonance 21, 524 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3