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1,8-(S),30-(R)-TRIHYDROXY-DOTRIACONTA-17-(Z),28-(E)-DIENE-2,4,6,15,31-PENTAYNE
SpectraBase Compound ID 2pC0pSq3qYN
InChI InChI=1S/C32H42O3/c1-2-31(34)27-23-19-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-20-24-28-32(35)29-25-21-18-22-26-30-33/h1,5,7,23,27,31-35H,3-4,6,8,10,12-17,19-20,24,28,30H2/b7-5-,27-23+/t31-,32-/m0/s1
InChIKey CVOHSXPVNKSLMG-HGMDRNRHSA-N
Mol Weight 474.7 g/mol
Molecular Formula C32H42O3
Exact Mass 474.313395 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FOLffcTLKkM
Name 1,8-(S),30-(R)-TRIHYDROXY-DOTRIACONTA-17-(Z),28-(E)-DIENE-2,4,6,15,31-PENTAYNE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H42O3
InChI InChI=1S/C32H42O3/c1-2-31(34)27-23-19-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-20-24-28-32(35)29-25-21-18-22-26-30-33/h1,5,7,23,27,31-35H,3-4,6,8,10,12-17,19-20,24,28,30H2/b7-5-,27-23+/t31-,32-/m0/s1
InChIKey CVOHSXPVNKSLMG-HGMDRNRHSA-N
Literature Reference Author J.R.DAI,Y.F.HALLOCK,J.H.CARDELLINA,G.N.GRAY,M.R.BOYD
Literature Reference Citation J.NAT.PROD.,59,860(1996)
Literature Reference DOI 10.1021/np960366i
Molecular Weight 474.684 g/mol
Solvent CDCl3
Source File Reference UWRK816