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3-(2-AMMONIUMETHYLTHIO)-PROPYL_7-O-CARBAMOYL-L-GLYCERO-ALPHA-D-MANNO-HEPTOPYRANOSIDE_ACETATE
SpectraBase Compound ID EBVAIbpdJ7x
InChI InChI=1S/C15H28N2O10S/c1-8(18)27-17-3-6-28-5-2-4-24-14-12(22)10(20)11(21)13(26-14)9(19)7-25-15(16)23/h9-14,17,19-22H,2-7H2,1H3,(H2,16,23)/t9-,10-,11-,12-,13+,14-/m0/s1
InChIKey LXMKNYCRWYOKBV-VZKILSJISA-N
Mol Weight 428.45 g/mol
Molecular Formula C15H28N2O10S
Exact Mass 428.146466 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7TCILEDDFlV
Name 3-(2-AMMONIUMETHYLTHIO)-PROPYL_7-O-CARBAMOYL-L-GLYCERO-ALPHA-D-MANNO-HEPTOPYRANOSIDE_ACETATE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H28N2O10S
InChI InChI=1S/C15H28N2O10S/c1-8(18)27-17-3-6-28-5-2-4-24-14-12(22)10(20)11(21)13(26-14)9(19)7-25-15(16)23/h9-14,17,19-22H,2-7H2,1H3,(H2,16,23)/t9-,10-,11-,12-,13+,14-/m0/s1
InChIKey LXMKNYCRWYOKBV-VZKILSJISA-N
Literature Reference Author A.REITER,A.ZAMYATINA,H.SCHINDL,A.HOFINGER,P.KOSMA
Literature Reference Citation CARBOHYDR.RES.,317,39(1999)
Literature Reference DOI 10.1016/S0008-6215(99)00059-2
Molecular Weight 428.455 g/mol
Solvent D2O
Source File Reference UWMZ4675