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7-O-ACETYLSECOPENICILLIDE_C

View entire compound with spectra: 1 NMR

7-O-ACETYLSECOPENICILLIDE_C
SpectraBase Compound ID L832GHkOxFM
InChI InChI=1S/C22H24O7/c1-12(2)5-6-15-7-8-18(19(20(15)25)22(26)27)29-21-16(11-28-14(4)23)9-13(3)10-17(21)24/h5,7-10,24-25H,6,11H2,1-4H3,(H,26,27)
InChIKey BSFKPIFPKWVNTR-UHFFFAOYSA-N
Mol Weight 400.43 g/mol
Molecular Formula C22H24O7
Exact Mass 400.152203 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C9e41tssJAV
Name 7-O-ACETYLSECOPENICILLIDE_C
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H24O7
InChI InChI=1S/C22H24O7/c1-12(2)5-6-15-7-8-18(19(20(15)25)22(26)27)29-21-16(11-28-14(4)23)9-13(3)10-17(21)24/h5,7-10,24-25H,6,11H2,1-4H3,(H,26,27)
InChIKey BSFKPIFPKWVNTR-UHFFFAOYSA-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 400.428 g/mol
Sample ID 41578
Solvent DMSO-D6