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5-ALPHA-CINNAMOYLOXY-2-ALPHA,9-ALPHA,10-BETA-TRIHYDROXYTAXA-4(20),11-DIEN-13-ONE
SpectraBase Compound ID 38rNr5tx4yr
InChI InChI=1S/C29H36O6/c1-16-20(30)15-19-25(32)24-17(2)21(35-22(31)12-11-18-9-7-6-8-10-18)13-14-29(24,5)27(34)26(33)23(16)28(19,3)4/h6-12,19,21,24-27,32-34H,2,13-15H2,1,3-5H3/b12-11+/t19-,21-,24-,25+,26+,27-,29+/m0/s1
InChIKey OFMCNWVMMIJDPE-UMOQMHEWSA-N
Mol Weight 480.6 g/mol
Molecular Formula C29H36O6
Exact Mass 480.251189 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JVFew5LxMtu
Name 5-ALPHA-CINNAMOYLOXY-2-ALPHA,9-ALPHA,10-BETA-TRIHYDROXYTAXA-4(20),11-DIEN-13-ONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H36O6
InChI InChI=1S/C29H36O6/c1-16-20(30)15-19-25(32)24-17(2)21(35-22(31)12-11-18-9-7-6-8-10-18)13-14-29(24,5)27(34)26(33)23(16)28(19,3)4/h6-12,19,21,24-27,32-34H,2,13-15H2,1,3-5H3/b12-11+/t19-,21-,24-,25+,26+,27-,29+/m0/s1
InChIKey OFMCNWVMMIJDPE-UMOQMHEWSA-N
Literature Reference Author S.ZHANG,J.WANG,K.HIROSE,M.ANDO
Literature Reference Citation J.NAT.PROD.,65,1786(2002)
Literature Reference DOI 10.1021/np020240n
Molecular Weight 480.601 g/mol
Solvent CDCl3
Source File Reference UWSI16410