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31-(R)-HYDROXY-TRITRIACONTA-4-(Z),15-(Z),29-(E)-TRIENE-2,32-DIYNOIC-ACID-METHYLESTER

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31-(R)-HYDROXY-TRITRIACONTA-4-(Z),15-(Z),29-(E)-TRIENE-2,32-DIYNOIC-ACID-METHYLESTER
SpectraBase Compound ID 59vzZGdoIJX
InChI InChI=1S/C34H54O3/c1-3-33(35)31-29-27-25-23-21-19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34(36)37-2/h1,4,6,26,28-29,31,33,35H,5,7-25,27H2,2H3/b6-4-,28-26-,31-29+/t33-/m0/s1
InChIKey DIJGNUNARSUQJU-OUSVFERLSA-N
Mol Weight 510.8 g/mol
Molecular Formula C34H54O3
Exact Mass 510.407296 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K6VDrOvviqN
Name 31-(R)-HYDROXY-TRITRIACONTA-4-(Z),15-(Z),29-(E)-TRIENE-2,32-DIYNOIC-ACID-METHYLESTER
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H54O3
InChI InChI=1S/C34H54O3/c1-3-33(35)31-29-27-25-23-21-19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34(36)37-2/h1,4,6,26,28-29,31,33,35H,5,7-25,27H2,2H3/b6-4-,28-26-,31-29+/t33-/m0/s1
InChIKey DIJGNUNARSUQJU-OUSVFERLSA-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 510.801 g/mol
Solvent CDCl3
Source File Reference UWRK820