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(2-S,3-S)-SULFATED_PTERSIN_C

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(2-S,3-S)-SULFATED_PTERSIN_C
SpectraBase Compound ID JmOpeERuw9I
InChI InChI=1S/C14H18O6S/c1-7-6-11-12(14(16)9(3)13(11)15)8(2)10(7)4-5-20-21(17,18)19/h6,9,13,15H,4-5H2,1-3H3,(H,17,18,19)/p-1/t9-,13-/m0/s1
InChIKey AJYKBYFVDNGNQI-ZANVPECISA-M
Mol Weight 313.34 g/mol
Molecular Formula C14H17O6S
Exact Mass 313.074584 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4wZ4OBikVMK
Name (2-S,3-S)-SULFATED_PTERSIN_C
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H17O6S
InChI InChI=1S/C14H18O6S/c1-7-6-11-12(14(16)9(3)13(11)15)8(2)10(7)4-5-20-21(17,18)19/h6,9,13,15H,4-5H2,1-3H3,(H,17,18,19)/p-1/t9-,13-/m0/s1
InChIKey AJYKBYFVDNGNQI-ZANVPECISA-M
Literature Reference Author S.J.UDDIN,T.L.H.JASON,K.D.BEATTIE,I.D.GRICE,E.TIRALONGO
Literature Reference Citation J.NAT.PROD.,74,2010(2011)
Literature Reference DOI 10.1021/np2004598
Molecular Weight 313.345 g/mol
Sample ID 39288
Solvent CD3OD