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BDIIBDOULXZFFR-UHFFFAOYSA-N
SpectraBase Compound ID GXosDIBhYzU
InChI InChI=1S/2C25H40O4S3/c2*1-5-7-8-9-10-11-12-22(31-25(30)29-6-2)19-21(4)24(26)17-18-32(27,28)23-15-13-20(3)14-16-23/h2*13-16,21-22H,5-12,17-19H2,1-4H3
InChIKey BDIIBDOULXZFFR-UHFFFAOYSA-N
Mol Weight 1001.5 g/mol
Molecular Formula C50H80O8S6
Exact Mass 1000.417747 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GbHuOr0ibCj
Name BDIIBDOULXZFFR-UHFFFAOYSA-N
Compound Number 1D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C50H80O8S6
InChI InChI=1S/2C25H40O4S3/c2*1-5-7-8-9-10-11-12-22(31-25(30)29-6-2)19-21(4)24(26)17-18-32(27,28)23-15-13-20(3)14-16-23/h2*13-16,21-22H,5-12,17-19H2,1-4H3
InChIKey BDIIBDOULXZFFR-UHFFFAOYSA-N
Literature Reference Author J.BOIVIN,R.JRAD,S.JUGE,V.T.NGUYEN
Literature Reference Citation ORG.LETTERS,5,1645(2003)
Literature Reference DOI 10.1021/ol0342610
Molecular Weight 1001.540 g/mol
Sample ID 48932
Solvent CDCl3