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MONOCILLIN_IV

View entire compound with spectra: 1 NMR

MONOCILLIN_IV
SpectraBase Compound ID Gm71bDjnmXS
InChI InChI=1S/C18H22O5/c1-12-7-5-3-2-4-6-8-14(19)9-13-10-15(20)11-16(21)17(13)18(22)23-12/h3,5,10-12,20-21H,2,4,6-9H2,1H3/b5-3+/t12-/m0/s1
InChIKey WSBASKMWDAUNEI-PYEVWLCESA-N
Mol Weight 318.37 g/mol
Molecular Formula C18H22O5
Exact Mass 318.146724 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A2atO0FA8m7
Name MONOCILLIN_IV
Compound Number 1
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22O5
InChI InChI=1S/C18H22O5/c1-12-7-5-3-2-4-6-8-14(19)9-13-10-15(20)11-16(21)17(13)18(22)23-12/h3,5,10-12,20-21H,2,4,6-9H2,1H3/b5-3+/t12-/m0/s1
InChIKey WSBASKMWDAUNEI-PYEVWLCESA-N
Literature Reference Author J.GAO,M.M.RADWAN,F.LEON,O.R.DALE,A.S.HUSNI,Y.WU,S.LUPIEN,X.W ANG,S.P.MANLY,R.A.HI
Literature Reference Citation J.NAT.PROD.,76,824(2013)
Literature Reference DOI 10.1021/np300653d
Molecular Weight 318.370 g/mol
Sample ID 42464
Solvent CDCl3