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Discodermolide
SpectraBase Compound ID 11EoQKyU5Dv
InChI InChI=1S/C33H55NO8/c1-10-11-12-20(4)31(42-33(34)40)24(8)29(37)22(6)16-18(2)15-21(5)28(36)19(3)13-14-26(35)17-27-23(7)30(38)25(9)32(39)41-27/h10-15,19-31,35-38H,1,16-17H2,2-9H3,(H2,34,40)/b12-11-,14-13-,18-15-/t19-,20-,21-,22-,23-,24+,25+,26+,27-,28+,29+,30-,31+/m1/s1
InChIKey AADVCYNFEREWOS-DPDAGQNXSA-N
Mol Weight 593.8 g/mol
Molecular Formula C33H55NO8
Exact Mass 593.392768 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6p2OtBPI7UK
Name DISCODERMOLIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H55NO8
InChI InChI=1S/C33H55NO8/c1-10-11-12-20(4)31(42-33(34)40)24(8)29(37)22(6)16-18(2)15-21(5)28(36)19(3)13-14-26(35)17-27-23(7)30(38)25(9)32(39)41-27/h10-15,19-31,35-38H,1,16-17H2,2-9H3,(H2,34,40)/b12-11-,14-13-,18-15-/t19-,20-,21-,22-,23-,24+,25+,26+,27-,28+,29+,30-,31+/m1/s1
InChIKey AADVCYNFEREWOS-DPDAGQNXSA-N
Literature Reference Author S.P.GUNASEKERA,M.GUNASEKERA,R.E.LONGLEY,G.K.SCHULTE
Literature Reference Citation J.ORG.CHEM.,55,4912(1990)
Literature Reference DOI 10.1021/jo00303a029
Molecular Weight 593.802 g/mol
Solvent CDCl3:CD3OD
Source File Reference UWED8371