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(+)-DISCODERMOLIDE
SpectraBase Compound ID BDNX2dmKbIM
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-ICNWDSOUSA-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 5hjfeTLlki0
Name (+)-DISCODERMOLIDE
Compound Number 1
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-ICNWDSOUSA-N
Literature Reference Author S.P.GUNASEKERA,S.J.MICKEL,R.DAEFFLER,D.NIEDERER,A.E.WRIGHT,P .LINLEY,T.PITTS
Literature Reference Citation J.NAT.PROD.,67,749(2004)
Literature Reference DOI 10.1021/np030493w
Molecular Weight 593.802 g/mol
Solvent CD3CN
Source File Reference UWMZ5732