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1-HYDROXY-8-EPI-5,6,11-TRIDEOXY-TETRODOTOXIN

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1-HYDROXY-8-EPI-5,6,11-TRIDEOXY-TETRODOTOXIN
SpectraBase Compound ID 6MFzWPbDAqT
InChI InChI=1S/C11H17N3O6/c1-3-2-4-8(17)13-10(12)14(19)11(4)6(15)5(3)20-9(18)7(11)16/h3-8,15-17,19H,2H2,1H3,(H2,12,13)/p+1/t3-,4-,5-,6+,7+,8-,11-/m0/s1
InChIKey SYWAZDOZRGIOJX-GISQOOOYSA-O
Mol Weight 288.28 g/mol
Molecular Formula C11H18N3O6
Exact Mass 288.11956 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5DkyKm1VhVx
Name 1-HYDROXY-8-EPI-5,6,11-TRIDEOXY-TETRODOTOXIN
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H17N3O6
InChI InChI=1S/C11H17N3O6/c1-3-2-4-8(17)13-10(12)14(19)11(4)6(15)5(3)20-9(18)7(11)16/h3-8,15-17,19H,2H2,1H3,(H2,12,13)/p+1/t3-,4-,5-,6+,7+,8-,11-/m0/s1
InChIKey SYWAZDOZRGIOJX-GISQOOOYSA-O
Literature Reference Author Y.KUDO,T.YASUMOTO,K.KONOKI,Y.CHO,M.YOTSU-YAMASHITA
Literature Reference Citation MAR.DRUGS,10,655(2012)
Literature Reference DOI 10.3390/md10030655
Molecular Weight 287.272 g/mol
Source File Reference UWIR5664