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(-)-(12-E,2-S,3-S,4-R,5-R,6-R,9-S,11-S,15-R)-3-ACETOXY-15-BENZOYLOXY-5,6-EPOXYLATHYR-12-EN-14-ONE
SpectraBase Compound ID IUSh9cZGS6M
InChI InChI=1S/C29H36O6/c1-16-14-21-20(27(21,4)5)12-13-28(6)25(34-28)22-23(33-18(3)30)17(2)15-29(22,24(16)31)35-26(32)19-10-8-7-9-11-19/h7-11,14,17,20-23,25H,12-13,15H2,1-6H3/b16-14+/t17-,20-,21+,22+,23-,25+,28+,29+/m0/s1
InChIKey KXWUYCUPBXTAIE-ZCBYPNIXSA-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 DNpG4mtX7gt
Name (-)-(12-E,2-S,3-S,4-R,5-R,6-R,9-S,11-S,15-R)-3-ACETOXY-15-BENZOYLOXY-5,6-EPOXYLATHYR-12-EN-14-ONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H36O6
InChI InChI=1S/C29H36O6/c1-16-14-21-20(27(21,4)5)12-13-28(6)25(34-28)22-23(33-18(3)30)17(2)15-29(22,24(16)31)35-26(32)19-10-8-7-9-11-19/h7-11,14,17,20-23,25H,12-13,15H2,1-6H3/b16-14+/t17-,20-,21+,22+,23-,25+,28+,29+/m0/s1
InChIKey KXWUYCUPBXTAIE-ZCBYPNIXSA-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 480.601 g/mol
Sample ID 38283
Solvent ACETONE-D6