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PAECILOCIN_D

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PAECILOCIN_D
SpectraBase Compound ID 5cgucWdsL3d
InChI InChI=1S/C16H22O3/c1-2-3-4-5-6-8-12-15(18)11-9-7-10-13(17)14(11)16(12)19/h7,9-10,12,16-17,19H,2-6,8H2,1H3/t12-,16+/m0/s1
InChIKey WRJIJSMXYWUZAJ-BLLLJJGKSA-N
Mol Weight 262.35 g/mol
Molecular Formula C16H22O3
Exact Mass 262.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IQrzEjTpV36
Name PAECILOCIN_D
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H22O3
InChI InChI=1S/C16H22O3/c1-2-3-4-5-6-8-12-15(18)11-9-7-10-13(17)14(11)16(12)19/h7,9-10,12,16-17,19H,2-6,8H2,1H3/t12-,16+/m0/s1
InChIKey WRJIJSMXYWUZAJ-BLLLJJGKSA-N
Literature Reference Author J.LIU,F.LI,E.L.KIM,J.J.LI,J.HONG,K.S.BAE,H.Y.CHUNG,H.S.KIM,J .H.JUNG
Literature Reference Citation J.NAT.PROD.,74,1826(2011)
Literature Reference DOI 10.1021/np200350b
Molecular Weight 262.349 g/mol
Sample ID 39168
Solvent CD3OD