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1-BETA-HYDROXY-2-DEACETOXYTAXININE-J;1-BETA-HYDROXY-7-BETA,9-ALPHA,10-BETA,13-ALPHA-TETRAACETOXY-5-ALPHA-CINNAMOYLOXY-TAXA-4(20),11-DIENE
SpectraBase Compound ID 72ULNsaLmOR
InChI InChI=1S/C37H46O11/c1-20-27-18-37(43)19-29(44-22(3)38)21(2)32(35(37,7)8)33(46-24(5)40)34(47-25(6)41)36(27,9)30(45-23(4)39)17-28(20)48-31(42)16-15-26-13-11-10-12-14-26/h10-16,27-30,33-34,43H,1,17-19H2,2-9H3/b16-15+/t27?,28-,29-,30-,33+,34-,36-,37-/m0/s1
InChIKey JXEOWCLOUFWNAU-OVKXNMPLSA-N
Mol Weight 666.8 g/mol
Molecular Formula C37H46O11
Exact Mass 666.304012 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4nowoigCkDl
Name 1-BETA-HYDROXY-2-DEACETOXYTAXININE-J;1-BETA-HYDROXY-7-BETA,9-ALPHA,10-BETA,13-ALPHA-TETRAACETOXY-5-ALPHA-CINNAMOYLOXY-TAXA-4(20),11-DIENE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H46O11
InChI InChI=1S/C37H46O11/c1-20-27-18-37(43)19-29(44-22(3)38)21(2)32(35(37,7)8)33(46-24(5)40)34(47-25(6)41)36(27,9)30(45-23(4)39)17-28(20)48-31(42)16-15-26-13-11-10-12-14-26/h10-16,27-30,33-34,43H,1,17-19H2,2-9H3/b16-15+/t27?,28-,29-,30-,33+,34-,36-,37-/m0/s1
InChIKey JXEOWCLOUFWNAU-OVKXNMPLSA-N
Literature Reference Author J.Z.ZHANG,Q.C.FANG,X.T.LIANG,C.H.HE,M.KONG,W.Y.HE,X.L.JIN
Literature Reference Citation PHYTOCHEM.,40,881(1995)
Literature Reference DOI 10.1016/0031-9422(95)00370-M
Molecular Weight 666.766 g/mol
Solvent CDCl3
Source File Reference UWMS2556