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PACHYCLAVULARIOLIDE-N
SpectraBase Compound ID H0objoEWI7x
InChI InChI=1S/C20H30O4/c1-12-6-5-7-13(2)16-8-9-20(4,24-16)18(21)11-15-14(3)19(22)23-17(15)10-12/h6,13,16-18,21H,5,7-11H2,1-4H3/b12-6+/t13-,16+,17+,18+,20-/m0/s1
InChIKey OFDXQVMWNHHDDC-OIXUOUKGSA-N
Mol Weight 334.46 g/mol
Molecular Formula C20H30O4
Exact Mass 334.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9VWHL0gaoGm
Name PACHYCLAVULARIOLIDE-N
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30O4
InChI InChI=1S/C20H30O4/c1-12-6-5-7-13(2)16-8-9-20(4,24-16)18(21)11-15-14(3)19(22)23-17(15)10-12/h6,13,16-18,21H,5,7-11H2,1-4H3/b12-6+/t13-,16+,17+,18+,20-/m0/s1
InChIKey OFDXQVMWNHHDDC-OIXUOUKGSA-N
Literature Reference Author J.H.SHEU,G.H.WANG,C.Y.DUH,K.SOONG
Literature Reference Citation J.NAT.PROD.,66,662(2003)
Literature Reference DOI 10.1021/np020603j
Molecular Weight 334.456 g/mol
Solvent CDCl3
Source File Reference UWSI7743