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2-(TETRADECYL)-HEXADECYL-3,6-DI-O-SULFO-BETA-D-GALACTOPYRANOSIDE-DISODIUM-SALT

View entire compound with spectra: 1 NMR

2-(TETRADECYL)-HEXADECYL-3,6-DI-O-SULFO-BETA-D-GALACTOPYRANOSIDE-DISODIUM-SALT
SpectraBase Compound ID BbsDHFA7Oop
InChI InChI=1S/C36H72O12S2.2Na/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-31(28-26-24-22-20-18-16-14-12-10-8-6-4-2)29-45-36-34(38)35(48-50(42,43)44)33(37)32(47-36)30-46-49(39,40)41;;/h31-38H,3-30H2,1-2H3,(H,39,40,41)(H,42,43,44);;/q;2*+1/p-2/t32-,33+,34-,35+,36-;;/m0../s1
InChIKey FMDHYZRIYPIRGL-CWGJZSKISA-L
Mol Weight 805.04353856 g/mol
Molecular Formula C36H70Na2O12S2
Exact Mass 804.410409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BCcBRnyoa9T
Name 2-(TETRADECYL)-HEXADECYL-3,6-DI-O-SULFO-BETA-D-GALACTOPYRANOSIDE-DISODIUM-SALT
Compound Number 7C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H70Na2O12S2
InChI InChI=1S/C36H72O12S2.2Na/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-31(28-26-24-22-20-18-16-14-12-10-8-6-4-2)29-45-36-34(38)35(48-50(42,43)44)33(37)32(47-36)30-46-49(39,40)41;;/h31-38H,3-30H2,1-2H3,(H,39,40,41)(H,42,43,44);;/q;2*+1/p-2/t32-,33+,34-,35+,36-;;/m0../s1
InChIKey FMDHYZRIYPIRGL-CWGJZSKISA-L
Literature Reference Author T.IKAMI,N.TSURUTA,H.INAGAKI,T.KAKIGAMI,Y.MATSUMOTO,N.TOMIYA, T.JOMORI,T.USUI,Y.SU
Literature Reference Citation CHEM.PHARM.BULL.,46,797(1998)
Literature Reference DOI 10.1248/cpb.46.797
Molecular Weight 805.044 g/mol
Solvent CD3OD:D2O=1:1
Source File Reference UWMS6336