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#7;N-TETRACOSANOYL-1-O-[6-O-(2-TRIMETHYLAMMONIOETHOXY)-PHOSPHINATE-BETA-D-GALACTOPYRANOSYL-(1->6)-BETA-D-GALACTOPYRANOSYL]-(4E)-16-METHYLHEPTADECASPHING
SpectraBase Compound ID fqf979hg2W
InChI InChI=1S/C59H115N2O16P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-28-31-34-37-40-51(63)60-47(48(62)39-36-33-30-27-25-24-26-29-32-35-38-46(2)3)43-72-58-56(68)54(66)52(64)49(76-58)44-73-59-57(69)55(67)53(65)50(77-59)45-75-78(70,71)74-42-41-61(4,5)6/h36,39,46-50,52-59,62,64-69H,7-35,37-38,40-45H2,1-6H3,(H-,60,63,70,71)/b39-36+/t47-,48+,49+,50-,52-,53+,54-,55+,56+,57-,58+,59-/m1/s1
InChIKey BPFWGEKNDUYDMY-PQZHQRQGSA-N
Mol Weight 1139.5 g/mol
Molecular Formula C59H115N2O16P
Exact Mass 1138.798423 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LycsZacIwov
Name #7;N-TETRACOSANOYL-1-O-[6-O-(2-TRIMETHYLAMMONIOETHOXY)-PHOSPHINATE-BETA-D-GALACTOPYRANOSYL-(1->6)-BETA-D-GALACTOPYRANOSYL]-(4E)-16-METHYLHEPTADECASPHING
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C59H115N2O16P
InChI InChI=1S/C59H115N2O16P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-28-31-34-37-40-51(63)60-47(48(62)39-36-33-30-27-25-24-26-29-32-35-38-46(2)3)43-72-58-56(68)54(66)52(64)49(76-58)44-73-59-57(69)55(67)53(65)50(77-59)45-75-78(70,71)74-42-41-61(4,5)6/h36,39,46-50,52-59,62,64-69H,7-35,37-38,40-45H2,1-6H3,(H-,60,63,70,71)/b39-36+/t47-,48+,49+,50-,52-,53+,54-,55+,56+,57-,58+,59-/m1/s1
InChIKey BPFWGEKNDUYDMY-PQZHQRQGSA-N
Literature Reference Author R.TANAKA,K.MIYAHARA,N.NODA
Literature Reference Citation CHEM.PHARM.BULL.,44,1152(1996)
Literature Reference DOI 10.1248/cpb.44.1152
Molecular Weight 1139.540 g/mol
Solvent CDCl3:CD3OD
Source File Reference UWLU31327