John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=3HQloNnUeAE SpectraBase Spectrum ID=2aZa7fVuLCV

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POUOGENIN_B
SpectraBase Compound ID 3HQloNnUeAE
InChI InChI=1S/C36H56O8/c1-22(13-16-31-35(9,10)33(41)18-19-36(31,11)44-27(6)39)12-15-28(42-25(4)37)20-24(3)30(43-26(5)38)21-29-23(2)14-17-32(40)34(29,7)8/h12,14,20,28-31,33,41H,13,15-19,21H2,1-11H3/b22-12+,24-20+/t28-,29-,30+,31+,33+,36+/m1/s1
InChIKey LOUNPPZOBFGBQD-MQQGKSLRSA-N
Mol Weight 616.8 g/mol
Molecular Formula C36H56O8
Exact Mass 616.397519 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2aZa7fVuLCV
Name POUOGENIN_B
Compound Number 6
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H56O8
InChI InChI=1S/C36H56O8/c1-22(13-16-31-35(9,10)33(41)18-19-36(31,11)44-27(6)39)12-15-28(42-25(4)37)20-24(3)30(43-26(5)38)21-29-23(2)14-17-32(40)34(29,7)8/h12,14,20,28-31,33,41H,13,15-19,21H2,1-11H3/b22-12+,24-20+/t28-,29-,30+,31+,33+,36+/m1/s1
InChIKey LOUNPPZOBFGBQD-MQQGKSLRSA-N
Literature Reference Author J.H.LEE,K.H.JANG,Y.J.LEE,H.S.LEE,C.J.SIM,K.B.OH,J.SHIN
Literature Reference Citation J.NAT.PROD.,74,2563(2011)
Literature Reference DOI 10.1021/np200748g
Molecular Weight 616.836 g/mol
Sample ID 39659
Solvent CD3OD
SpectraBase Batch ID 2VkB8axgEf4