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2-(TETRADECYL)-HEXADECYL-O-(3-O-SULFO-BETA-D-GALACTOPYRANOSYL)-(1->4)-BETA-D-GLUCOPYRANOSIDE-SODIUM-SALT
SpectraBase Compound ID 2zgGNRsHZEB
InChI InChI=1S/C42H82O14S.Na/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-32(28-26-24-22-20-18-16-14-12-10-8-6-4-2)31-52-41-37(47)36(46)39(34(30-44)54-41)55-42-38(48)40(56-57(49,50)51)35(45)33(29-43)53-42;/h32-48H,3-31H2,1-2H3,(H,49,50,51);/q;+1/p-1/t33-,34-,35+,36-,37-,38-,39-,40+,41-,42+;/m1./s1
InChIKey UUQVTMANWDCRKD-VMYBVFCJSA-M
Mol Weight 865.1 g/mol
Molecular Formula C42H81NaO14S
Exact Mass 864.524473 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FhpVTpzONfj
Name 2-(TETRADECYL)-HEXADECYL-O-(3-O-SULFO-BETA-D-GALACTOPYRANOSYL)-(1->4)-BETA-D-GLUCOPYRANOSIDE-SODIUM-SALT
Compound Number 11C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H81NaO14S
InChI InChI=1S/C42H82O14S.Na/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-32(28-26-24-22-20-18-16-14-12-10-8-6-4-2)31-52-41-37(47)36(46)39(34(30-44)54-41)55-42-38(48)40(56-57(49,50)51)35(45)33(29-43)53-42;/h32-48H,3-31H2,1-2H3,(H,49,50,51);/q;+1/p-1/t33-,34-,35+,36-,37-,38-,39-,40+,41-,42+;/m1./s1
InChIKey UUQVTMANWDCRKD-VMYBVFCJSA-M
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 865.147 g/mol
Solvent DMSO-D6
Source File Reference UWMS6344