For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

PROISOCRININ_B

View entire compound with spectra: 1 NMR

PROISOCRININ_B
SpectraBase Compound ID LWQz44ENzoJ
InChI InChI=1S/C20H17Br3O9S.Na/c1-3-4-8(32-33(28,29)30)5-7-6-9(24)10-11(14(7)21)18(26)12-13(17(10)25)20(31-2)16(23)19(27)15(12)22;/h6,8,24,27H,3-5H2,1-2H3,(H,28,29,30);/q;+1/p-1
InChIKey BFHJJYWPLIHPJB-UHFFFAOYSA-M
Mol Weight 695.1 g/mol
Molecular Formula C20H16Br3NaO9S
Exact Mass 691.796287 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EzWMQ1RzOm3
Name PROISOCRININ_B
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H16Br3NaO9S
InChI InChI=1S/C20H17Br3O9S.Na/c1-3-4-8(32-33(28,29)30)5-7-6-9(24)10-11(14(7)21)18(26)12-13(17(10)25)20(31-2)16(23)19(27)15(12)22;/h6,8,24,27H,3-5H2,1-2H3,(H,28,29,30);/q;+1/p-1
InChIKey BFHJJYWPLIHPJB-UHFFFAOYSA-M
Literature Reference Author K.WOLKENSTEIN,W.SCHOEFBERGER,N.MUELLER,T.OJI
Literature Reference Citation J.NAT.PROD.,72,2036(2009)
Literature Reference DOI 10.1021/np900171h
Molecular Weight 695.103 g/mol
Sample ID 34126
Solvent D2O