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VXYUEPSEJZHMSE-LKDCRAERSA-M
SpectraBase Compound ID 1URMN4UfmsS
InChI InChI=1S/C27H48O9S.Na/c1-15(14-36-37(33,34)35)6-5-7-16(2)21-23(30)24(31)22-18-12-20(29)27(32)13-17(28)8-11-26(27,4)19(18)9-10-25(21,22)3;/h15-24,28-32H,5-14H2,1-4H3,(H,33,34,35);/q;+1/p-1/t15-,16-,17+,18?,19?,20-,21+,22?,23-,24-,25-,26-,27+;/m1./s1
InChIKey VXYUEPSEJZHMSE-LKDCRAERSA-M
Mol Weight 570.7 g/mol
Molecular Formula C27H47NaO9S
Exact Mass 570.283849 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7HYKtC3rL2y
Name VXYUEPSEJZHMSE-LKDCRAERSA-M
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H47NaO9S
InChI InChI=1S/C27H48O9S.Na/c1-15(14-36-37(33,34)35)6-5-7-16(2)21-23(30)24(31)22-18-12-20(29)27(32)13-17(28)8-11-26(27,4)19(18)9-10-25(21,22)3;/h15-24,28-32H,5-14H2,1-4H3,(H,33,34,35);/q;+1/p-1/t15-,16-,17+,18?,19?,20-,21+,22?,23-,24-,25-,26-,27+;/m1./s1
InChIKey VXYUEPSEJZHMSE-LKDCRAERSA-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 570.715 g/mol
Solvent CD3OD
Source File Reference UWVP4472