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BENZYL 3,4,6-TRI-O-BENZOYL-2-O-(2,3,4,6-TETRA-O-BENZOYL-ALPHA-D-MANNOPYRANOSYLPHOSPHO)-BETA-D-GALACTOPYRANOSIDE, TRIETHYLAMMONIUM SALT
SpectraBase Compound ID KWqEkUPJ2c9
InChI InChI=1S/C68H57O21P.C6H15N/c69-60(45-27-11-2-12-28-45)78-42-52-55(84-63(72)48-33-17-5-18-34-48)57(86-65(74)50-37-21-7-22-38-50)59(67(81-52)80-41-44-25-9-1-10-26-44)88-90(76,77)89-68-58(87-66(75)51-39-23-8-24-40-51)56(85-64(73)49-35-19-6-20-36-49)54(83-62(71)47-31-15-4-16-32-47)53(82-68)43-79-61(70)46-29-13-3-14-30-46;1-4-7(5-2)6-3/h1-40,52-59,67-68H,41-43H2,(H,76,77);4-6H2,1-3H3/t52-,53-,54-,55+,56+,57+,58+,59-,67-,68-;/m1./s1
InChIKey YTOUTFSLIUNNNI-SOBWHGIKSA-N
Mol Weight 1342.3 g/mol
Molecular Formula C74H72NO21P
Exact Mass 1341.433445 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID El3ajYi4rUN
Name BENZYL 3,4,6-TRI-O-BENZOYL-2-O-(2,3,4,6-TETRA-O-BENZOYL-ALPHA-D-MANNOPYRANOSYLPHOSPHO)-BETA-D-GALACTOPYRANOSIDE, TRIETHYLAMMONIUM SALT
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C74H72NO21P
InChI InChI=1S/C68H57O21P.C6H15N/c69-60(45-27-11-2-12-28-45)78-42-52-55(84-63(72)48-33-17-5-18-34-48)57(86-65(74)50-37-21-7-22-38-50)59(67(81-52)80-41-44-25-9-1-10-26-44)88-90(76,77)89-68-58(87-66(75)51-39-23-8-24-40-51)56(85-64(73)49-35-19-6-20-36-49)54(83-62(71)47-31-15-4-16-32-47)53(82-68)43-79-61(70)46-29-13-3-14-30-46;1-4-7(5-2)6-3/h1-40,52-59,67-68H,41-43H2,(H,76,77);4-6H2,1-3H3/t52-,53-,54-,55+,56+,57+,58+,59-,67-,68-;/m1./s1
InChIKey YTOUTFSLIUNNNI-SOBWHGIKSA-N
Instrument Name Bruker WM-250
Literature Reference A.V.NIKOLAEV, I.A.IVANOVA, V.N.SHIBAEV, N.K.KOCHETKOV (1990)Bioorganich.Khim.(Russ. Lang.): v.16, N8, 1105-1117.
NMR Standard not reported
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d