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5-(2-AMINOETHYLTHIO)-PENTYL-3,6-DIDEOXY-ALPHA-D-ARABINO-HEXOPYRANOSYL-(1->3)-ALPHA-D-MANNOPYRANOSIDE-ACID-ACETIC-SALT
SpectraBase Compound ID rF44BVif11
InChI InChI=1S/C19H37NO9S.C2H4O2/c1-11-12(22)9-13(23)18(27-11)29-17-15(24)14(10-21)28-19(16(17)25)26-6-3-2-4-7-30-8-5-20;1-2(3)4/h11-19,21-25H,2-10,20H2,1H3;1H3,(H,3,4)/t11-,12+,13+,14-,15-,16+,17+,18-,19+;/m1./s1
InChIKey OSUFQNLNUBUOAF-TWBCARHHSA-N
Mol Weight 515.6 g/mol
Molecular Formula C21H41NO11S
Exact Mass 515.240032 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ARsTk1WotRU
Name 5-(2-AMINOETHYLTHIO)-PENTYL-3,6-DIDEOXY-ALPHA-D-ARABINO-HEXOPYRANOSYL-(1->3)-ALPHA-D-MANNOPYRANOSIDE-ACID-ACETIC-SALT
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H41NO11S
InChI InChI=1S/C19H37NO9S.C2H4O2/c1-11-12(22)9-13(23)18(27-11)29-17-15(24)14(10-21)28-19(16(17)25)26-6-3-2-4-7-30-8-5-20;1-2(3)4/h11-19,21-25H,2-10,20H2,1H3;1H3,(H,3,4)/t11-,12+,13+,14-,15-,16+,17+,18-,19+;/m1./s1
InChIKey OSUFQNLNUBUOAF-TWBCARHHSA-N
Literature Reference Author H.N.YU,C.C.LING,D.R.BUNDLE
Literature Reference Citation CAN.J.CHEM.,80,1131(2002)
Literature Reference DOI 10.1139/v02-121
Molecular Weight 515.617 g/mol
Solvent D2O
Source File Reference UWVN27276