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5-ALPHA,7-BETA,10-BETA-TRIACETOXY-2-ALPHA-(ALPHA-METHYLBUTYROXY)-4(20),11-TAXADIEN
SpectraBase Compound ID Bp1RAG0p6CS
InChI InChI=1S/C31H46O8/c1-11-16(2)29(35)39-28-22-13-12-17(3)26(30(22,8)9)24(37-20(6)33)15-31(10)25(38-21(7)34)14-23(36-19(5)32)18(4)27(28)31/h16,22-25,27-28H,4,11-15H2,1-3,5-10H3/t16?,22-,23-,24-,25-,27-,28+,31+/m0/s1
InChIKey CHMYZBJEIMOLSS-PZUGWZGFSA-N
Mol Weight 546.7 g/mol
Molecular Formula C31H46O8
Exact Mass 546.319268 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6WMAmxd77vI
Name 5-ALPHA,7-BETA,10-BETA-TRIACETOXY-2-ALPHA-(ALPHA-METHYLBUTYROXY)-4(20),11-TAXADIEN
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H46O8
InChI InChI=1S/C31H46O8/c1-11-16(2)29(35)39-28-22-13-12-17(3)26(30(22,8)9)24(37-20(6)33)15-31(10)25(38-21(7)34)14-23(36-19(5)32)18(4)27(28)31/h16,22-25,27-28H,4,11-15H2,1-3,5-10H3/t16?,22-,23-,24-,25-,27-,28+,31+/m0/s1
InChIKey CHMYZBJEIMOLSS-PZUGWZGFSA-N
Literature Reference Author D.DEMARCANO,B.MENDEZ,J.MENDEZ,J.MONASTERIOS,A.C.ROJAS
Literature Reference Citation ORG.MAGN.RES.,21,524(1983)
Literature Reference DOI 10.1002/omr.1270210814
Molecular Weight 546.701 g/mol
Solvent CDCl3
Source File Reference UNIW7970