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2-ALPHA,5-ALPHA,10-BETA-TRI-ACETOXY-14-BETA-(2-METHYL)-BUTYRYLOXY-4(20),11-TAXADIENE
SpectraBase Compound ID JTbkmO52oSR
InChI InChI=1S/C31H46O8/c1-11-16(2)29(35)39-23-14-17(3)25-24(37-20(6)33)15-31(10)13-12-22(36-19(5)32)18(4)26(31)28(38-21(7)34)27(23)30(25,8)9/h16,22-24,26-28H,4,11-15H2,1-3,5-10H3/t16?,22-,23-,24-,26-,27-,28-,31-/m0/s1
InChIKey USNOOZXSAIYFCE-ALLYKNSASA-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 C650Kf65qq3
Name 2-ALPHA,5-ALPHA,10-BETA-TRI-ACETOXY-14-BETA-(2-METHYL)-BUTYRYLOXY-4(20),11-TAXADIENE
Compound Number 5
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)39-23-14-17(3)25-24(37-20(6)33)15-31(10)13-12-22(36-19(5)32)18(4)26(31)28(38-21(7)34)27(23)30(25,8)9/h16,22-24,26-28H,4,11-15H2,1-3,5-10H3/t16?,22-,23-,24-,26-,27-,28-,31-/m0/s1
InChIKey USNOOZXSAIYFCE-ALLYKNSASA-N
Literature Reference Author W.MA,R.W.STAHLHUT,T.L.ADAMS,G.L.PARK,W.A.EVANS,S.G.BLUMENTHA L,G.A.GOMEZ,M.H.NIED
Literature Reference Citation J.NAT.PROD.,57,1320(1994)
Literature Reference DOI 10.1021/np50111a027
Molecular Weight 546.701 g/mol
Solvent CDCl3
Source File Reference UWTS1978