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KEYPTSCPBGDWQN-WCXQMFAGSA-N

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KEYPTSCPBGDWQN-WCXQMFAGSA-N
SpectraBase Compound ID 6GCYoYFvGM9
InChI InChI=1S/C25H42O8S3/c1-26-16-28-22(20-14-34-9-3-24(20)30-5-6-31-24)18-11-19(13-36-12-18)23(29-17-27-2)21-15-35-10-4-25(21)32-7-8-33-25/h18-23H,3-17H2,1-2H3/t18-,19+,20-,21+,22+,23-
InChIKey KEYPTSCPBGDWQN-WCXQMFAGSA-N
Mol Weight 566.8 g/mol
Molecular Formula C25H42O8S3
Exact Mass 566.204182 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LAbLARnW8X6
Name KEYPTSCPBGDWQN-WCXQMFAGSA-N
Compound Number S7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H42O8S3
InChI InChI=1S/C25H42O8S3/c1-26-16-28-22(20-14-34-9-3-24(20)30-5-6-31-24)18-11-19(13-36-12-18)23(29-17-27-2)21-15-35-10-4-25(21)32-7-8-33-25/h18-23H,3-17H2,1-2H3/t18-,19+,20-,21+,22+,23-
InChIKey KEYPTSCPBGDWQN-WCXQMFAGSA-N
Literature Reference Author D.E.WARD,H.M.GILLIS,O.T.AKINNUSI,M.A.RASHEED,K.SARAVANAN,P.K .SASMAL
Literature Reference Citation ORG.LETTERS,8,2631(2006)
Literature Reference DOI 10.1021/ol060802k
Molecular Weight 566.784 g/mol
Sample ID 58108
Solvent CDCl3