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(-)-(5-E,12-E,2-S,3-S,4-S,9-S,11-S,15-R)-15-CINNAMOYLOXYLATHYRA-5,12-DIEN-3-OL-14-ONE
SpectraBase Compound ID HWEWwpvFiTi
InChI InChI=1S/C29H36O4/c1-18-11-13-22-23(28(22,4)5)16-19(2)27(32)29(17-20(3)26(31)24(29)15-18)33-25(30)14-12-21-9-7-6-8-10-21/h6-10,12,14-16,20,22-24,26,31H,11,13,17H2,1-5H3/b14-12+,18-15+,19-16+/t20-,22-,23+,24-,26-,29+/m0/s1
InChIKey CECZLHJZSYFSLY-YUPKHPILSA-N
Mol Weight 448.6 g/mol
Molecular Formula C29H36O4
Exact Mass 448.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dj7fD0COC3z
Name (-)-(5-E,12-E,2-S,3-S,4-S,9-S,11-S,15-R)-15-CINNAMOYLOXYLATHYRA-5,12-DIEN-3-OL-14-ONE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H36O4
InChI InChI=1S/C29H36O4/c1-18-11-13-22-23(28(22,4)5)16-19(2)27(32)29(17-20(3)26(31)24(29)15-18)33-25(30)14-12-21-9-7-6-8-10-21/h6-10,12,14-16,20,22-24,26,31H,11,13,17H2,1-5H3/b14-12+,18-15+,19-16+/t20-,22-,23+,24-,26-,29+/m0/s1
InChIKey CECZLHJZSYFSLY-YUPKHPILSA-N
Literature Reference Author Y.TIAN,W.XU,C.ZHU,S.LIN,Y.LI,L.XIONG,S.WANG,L.WANG,Y.YANG,Y. GUO,H.SUN,X.WANG,J.S
Literature Reference Citation J.NAT.PROD.,74,1221(2011)
Literature Reference DOI 10.1021/np2001489
Molecular Weight 448.602 g/mol
Sample ID 38287
Solvent ACETONE-D6