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Destruxin A chlorohydrin
SpectraBase Compound ID 3IO5m0MJceI
InChI InChI=1S/C29H48ClN5O8/c1-8-17(4)23-28(41)34(7)24(16(2)3)29(42)33(6)18(5)25(38)31-12-11-22(37)43-21(14-19(36)15-30)27(40)35-13-9-10-20(35)26(39)32-23/h16-21,23-24,36H,8-15H2,1-7H3,(H,31,38)(H,32,39)
InChIKey WUTLOXOGFQPKLT-UHFFFAOYSA-N
Mol Weight 630.2 g/mol
Molecular Formula C29H48ClN5O8
Exact Mass 629.319141 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8wRSnKUxIi1
Name Destruxin A chlorohydrin
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C29H48ClN5O8
InChI InChI=1S/C29H48ClN5O8/c1-8-17(4)23-28(41)34(7)24(16(2)3)29(42)33(6)18(5)25(38)31-12-11-22(37)43-21(14-19(36)15-30)27(40)35-13-9-10-20(35)26(39)32-23/h16-21,23-24,36H,8-15H2,1-7H3,(H,31,38)(H,32,39)
InChIKey WUTLOXOGFQPKLT-UHFFFAOYSA-N
Instrument Name Varian XL-400
Literature Reference S. Gupta, D.W. Roberts, J.A. Renwick, J. Chem. Soc. Perkin I 2347 (1989).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3