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PLATENCIN_SL4;7-HYDROXY-ENT-ATISEREN-19-OIC_ACID_S-NAC-DERIVATIVE
SpectraBase Compound ID KGvPIP2rO1M
InChI InChI=1S/C24H37NO3S/c1-15-14-24-9-6-17(15)12-19(24)22(3)7-5-8-23(4,18(22)13-20(24)27)21(28)29-11-10-25-16(2)26/h17-20,27H,1,5-14H2,2-4H3,(H,25,26)/t17-,18-,19-,20+,22+,23+,24+/m0/s1
InChIKey TYSIZTKCMZPPFU-ULLHZWNJSA-N
Mol Weight 419.6 g/mol
Molecular Formula C24H37NO3S
Exact Mass 419.249415 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 88LIVeg1372
Name PLATENCIN_SL4;7-HYDROXY-ENT-ATISEREN-19-OIC_ACID_S-NAC-DERIVATIVE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H37NO3S
InChI InChI=1S/C24H37NO3S/c1-15-14-24-9-6-17(15)12-19(24)22(3)7-5-8-23(4,18(22)13-20(24)27)21(28)29-11-10-25-16(2)26/h17-20,27H,1,5-14H2,2-4H3,(H,25,26)/t17-,18-,19-,20+,22+,23+,24+/m0/s1
InChIKey TYSIZTKCMZPPFU-ULLHZWNJSA-N
Literature Reference Author M.J.SMANSKI,J.CASPER,R.M.PETERSON,Z.YU,S.R.RAJSKI,B.SHEN
Literature Reference Citation J.NAT.PROD.,75,2158(2012)
Literature Reference DOI 10.1021/np3005985
Molecular Weight 419.623 g/mol
Sample ID 42071
Solvent C5D5N