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(2S,3R,4E)-1,3-DIHYDROXY-2-[(HENEICOSANOYL)-AMINO]-4-HENEICOSENE

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(2S,3R,4E)-1,3-DIHYDROXY-2-[(HENEICOSANOYL)-AMINO]-4-HENEICOSENE
SpectraBase Compound ID 19aZsW5Q7Ml
InChI InChI=1S/C42H83NO3/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-38-42(46)43-40(39-44)41(45)37-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h35,37,40-41,44-45H,3-34,36,38-39H2,1-2H3,(H,43,46)/b37-35+/t40-,41+/m0/s1
InChIKey TURCGDDLSDFLSQ-AUTSUKAISA-N
Mol Weight 650.1 g/mol
Molecular Formula C42H83NO3
Exact Mass 649.637296 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ArApVHPrMuR
Name (2S,3R,4E)-1,3-DIHYDROXY-2-[(HENEICOSANOYL)-AMINO]-4-HENEICOSENE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H83NO3
InChI InChI=1S/C42H83NO3/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-38-42(46)43-40(39-44)41(45)37-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h35,37,40-41,44-45H,3-34,36,38-39H2,1-2H3,(H,43,46)/b37-35+/t40-,41+/m0/s1
InChIKey TURCGDDLSDFLSQ-AUTSUKAISA-N
Literature Reference Author G.B.S.REDDY,N.DHNANJAYA
Literature Reference Citation BIOORG.MED.CHEM.,8,27(2000)
Literature Reference DOI 10.1016/S0968-0896(99)00274-6
Molecular Weight 650.126 g/mol
Solvent C5D5N
Source File Reference UWVN20021