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MONORDEN-D;13-CHLORO-3,4,7,8-TETRAHYDRO-14,16-DIHYDROXY-3-METHYL-1H-2-BENZOXACYClOTETRADECIN-1,11(12H)-DIONE
SpectraBase Compound ID F7mSCV33gbk
InChI InChI=1S/C18H19ClO5/c1-11-7-5-3-2-4-6-8-12(20)9-13-16(18(23)24-11)14(21)10-15(22)17(13)19/h3,5-6,8,10-11,21-22H,2,4,7,9H2,1H3/b5-3+,8-6+
InChIKey FJVQHTGEXYKKBS-QFXXITGJSA-N
Mol Weight 350.8 g/mol
Molecular Formula C18H19ClO5
Exact Mass 350.092101 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AIoEHeXUbcb
Name MONORDEN-D;13-CHLORO-3,4,7,8-TETRAHYDRO-14,16-DIHYDROXY-3-METHYL-1H-2-BENZOXACYClOTETRADECIN-1,11(12H)-DIONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H19ClO5
InChI InChI=1S/C18H19ClO5/c1-11-7-5-3-2-4-6-8-12(20)9-13-16(18(23)24-11)14(21)10-15(22)17(13)19/h3,5-6,8,10-11,21-22H,2,4,7,9H2,1H3/b5-3+,8-6+
InChIKey FJVQHTGEXYKKBS-QFXXITGJSA-N
Literature Reference Author K.YAMAMOTO,H.HATANO,M.ARAI,K.SHIOMI,H.TOMODA,S.OMURA
Literature Reference Citation J.ANTIBIOTICS,56,533(2003)
Literature Reference DOI 10.7164/antibiotics.56.533
Molecular Weight 350.799 g/mol
Solvent CD3OD
Source File Reference UWSP4