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PACHYCLAVULARIOLIDE-P
SpectraBase Compound ID 8gmpHvZQ9MZ
InChI InChI=1S/C20H28O5/c1-11-6-5-7-12(2)15-8-9-20(4,25-15)18(22)17-16(14(21)10-11)13(3)19(23)24-17/h6,12,15,17-18,22H,5,7-10H2,1-4H3/b11-6+/t12-,15+,17-,18+,20-/m0/s1
InChIKey RVBQDBFIFUYZKG-ZCSWNNQCSA-N
Mol Weight 348.44 g/mol
Molecular Formula C20H28O5
Exact Mass 348.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DnGkIn2Ou96
Name PACHYCLAVULARIOLIDE-P
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O5
InChI InChI=1S/C20H28O5/c1-11-6-5-7-12(2)15-8-9-20(4,25-15)18(22)17-16(14(21)10-11)13(3)19(23)24-17/h6,12,15,17-18,22H,5,7-10H2,1-4H3/b11-6+/t12-,15+,17-,18+,20-/m0/s1
InChIKey RVBQDBFIFUYZKG-ZCSWNNQCSA-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 348.439 g/mol
Solvent CDCl3
Source File Reference UWSI7745