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7-BETA,9-ALPHA,10-BETA-TRIACETOXY-2-ALPHA-(ALPHA-METHYLBUTYROXY)-4(20),11-TAXADIEN-5-ALPHA-OL
SpectraBase Compound ID 1aQQrfAbtCE
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/t15?,21-,22-,23-,25-,26+,27+,28-,31+/m0/s1
InChIKey RIHLIEZPEMBSOA-UXOKKMBSSA-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 3pXVlYturLO
Name 7-BETA,9-ALPHA,10-BETA-TRIACETOXY-2-ALPHA-(ALPHA-METHYLBUTYROXY)-4(20),11-TAXADIEN-5-ALPHA-OL
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. 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/t15?,21-,22-,23-,25-,26+,27+,28-,31+/m0/s1
InChIKey RIHLIEZPEMBSOA-UXOKKMBSSA-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 562.701 g/mol
Solvent CDCl3
Source File Reference UNIW7969