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SODIUM-(METHYL-6,7-DIDEOXY-ALPHA-D-MANNO-OCTOPYRANOSIDE)-URONATE
SpectraBase Compound ID 3tGVpHdwr18
InChI InChI=1S/C9H16O7.Na/c1-15-9-8(14)7(13)6(12)4(16-9)2-3-5(10)11;/h4,6-9,12-14H,2-3H2,1H3,(H,10,11);/q;+1/p-1/t4-,6-,7+,8+,9+;/m1./s1
InChIKey CEDJXDXXSOKGFJ-JYZXNKRMSA-M
Mol Weight 258.2 g/mol
Molecular Formula C9H15NaO7
Exact Mass 258.071547 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4UDPcsFKGnc
Name SODIUM-(METHYL-6,7-DIDEOXY-ALPHA-D-MANNO-OCTOPYRANOSIDE)-URONATE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H15NaO7
InChI InChI=1S/C9H16O7.Na/c1-15-9-8(14)7(13)6(12)4(16-9)2-3-5(10)11;/h4,6-9,12-14H,2-3H2,1H3,(H,10,11);/q;+1/p-1/t4-,6-,7+,8+,9+;/m1./s1
InChIKey CEDJXDXXSOKGFJ-JYZXNKRMSA-M
Literature Reference Author S.VIDAL,M.GARCIA,J.L.MONTERO,A.MORERE
Literature Reference Citation BIOORG.MED.CHEM.,10,4051(2002)
Literature Reference DOI 10.1016/S0968-0896(02)00264-X
Molecular Weight 258.204 g/mol
Solvent DMSO-D6
Source File Reference UWLU31523