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DELTA-(1',3')-1'-DEHYDOXYPENICILLIDE
SpectraBase Compound ID I5TGDPwOimr
InChI InChI=1S/C21H20O5/c1-12(2)5-6-14-7-8-17-18(20(14)24-4)21(23)25-11-15-9-13(3)10-16(22)19(15)26-17/h5-10,22H,1,11H2,2-4H3/b6-5+
InChIKey XBAIUNZIMJALOJ-AATRIKPKSA-N
Mol Weight 352.39 g/mol
Molecular Formula C21H20O5
Exact Mass 352.131074 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 62SzYrI9jcB
Name DELTA-(1',3')-1'-DEHYDOXYPENICILLIDE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H20O5
InChI InChI=1S/C21H20O5/c1-12(2)5-6-14-7-8-17-18(20(14)24-4)21(23)25-11-15-9-13(3)10-16(22)19(15)26-17/h5-10,22H,1,11H2,2-4H3/b6-5+
InChIKey XBAIUNZIMJALOJ-AATRIKPKSA-N
Literature Reference Author Y.ZHANG,X.M.LI,Z.SHANG,C.S.LI,N.Y.JI,B.G.WANG
Literature Reference Citation J.NAT.PROD.,75,1888(2012)
Literature Reference DOI 10.1021/np300377b
Molecular Weight 352.387 g/mol
Sample ID 41577
Solvent DMSO-D6