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VQINYLUTCJMKCN-GFEBKTAKSA-M
SpectraBase Compound ID 99xDQoeD8BC
InChI InChI=1S/C27H48O8S.Na/c1-15(2)21(29)7-6-16(3)20-13-22(35-36(32,33)34)24-18-12-23(30)27(31)14-17(28)8-11-26(27,5)19(18)9-10-25(20,24)4;/h15-24,28-31H,6-14H2,1-5H3,(H,32,33,34);/q;+1/p-1/t16-,17+,18?,19?,20-,21-,22+,23-,24?,25-,26-,27+;/m1./s1
InChIKey VQINYLUTCJMKCN-GFEBKTAKSA-M
Mol Weight 554.7 g/mol
Molecular Formula C27H47NaO8S
Exact Mass 554.288934 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Nj0nyBz2PK
Name VQINYLUTCJMKCN-GFEBKTAKSA-M
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H47NaO8S
InChI InChI=1S/C27H48O8S.Na/c1-15(2)21(29)7-6-16(3)20-13-22(35-36(32,33)34)24-18-12-23(30)27(31)14-17(28)8-11-26(27,5)19(18)9-10-25(20,24)4;/h15-24,28-31H,6-14H2,1-5H3,(H,32,33,34);/q;+1/p-1/t16-,17+,18?,19?,20-,21-,22+,23-,24?,25-,26-,27+;/m1./s1
InChIKey VQINYLUTCJMKCN-GFEBKTAKSA-M
Literature Reference Author M.IORIZZI,P.BRYAN,J.MCCLINTOCK,L.MINALE,E.PALAGIANO,S.MAUREL LI,R.RICCIO,F.ZOLLO
Literature Reference Citation J.NAT.PROD.,58,653(1995)
Literature Reference DOI 10.1021/np50119a003
Molecular Weight 554.715 g/mol
Solvent CD3OD
Source File Reference UWVP4476