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(2S,3S,4R)-3,4-DI-O-BENZOYL-N-TETRACOSANOYL-1-O-TRIPHENYLMETHYL-2-AMINO-1,3,4-OCTADECANETRIOL
SpectraBase Compound ID NFYI0fM0h3
InChI InChI=1S/C75H107NO6/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-27-29-31-33-50-62-71(77)76-69(63-80-75(66-55-43-36-44-56-66,67-57-45-37-46-58-67)68-59-47-38-48-60-68)72(82-74(79)65-53-41-35-42-54-65)70(81-73(78)64-51-39-34-40-52-64)61-49-32-30-28-26-16-14-12-10-8-6-4-2/h34-48,51-60,69-70,72H,3-33,49-50,61-63H2,1-2H3,(H,76,77)/t69-,70+,72-/m0/s1
InChIKey GUMXLEVJEUWXBB-NJFKMOKHSA-N
Mol Weight 1118.7 g/mol
Molecular Formula C75H107NO6
Exact Mass 1117.80984 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HF6bzMV2Q50
Name (2S,3S,4R)-3,4-DI-O-BENZOYL-N-TETRACOSANOYL-1-O-TRIPHENYLMETHYL-2-AMINO-1,3,4-OCTADECANETRIOL
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C75H107NO6
InChI InChI=1S/C75H107NO6/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-27-29-31-33-50-62-71(77)76-69(63-80-75(66-55-43-36-44-56-66,67-57-45-37-46-58-67)68-59-47-38-48-60-68)72(82-74(79)65-53-41-35-42-54-65)70(81-73(78)64-51-39-34-40-52-64)61-49-32-30-28-26-16-14-12-10-8-6-4-2/h34-48,51-60,69-70,72H,3-33,49-50,61-63H2,1-2H3,(H,76,77)/t69-,70+,72-/m0/s1
InChIKey GUMXLEVJEUWXBB-NJFKMOKHSA-N
Literature Reference Author K.KOIKE,Y.NAKAHARA,T.OGAWA
Literature Reference Citation AGR.BIOL.CHEM.,54,663(1990)
Literature Reference DOI 10.1271/bbb1961.54.663
Molecular Weight 1118.678 g/mol
Solvent CDCl3
Source File Reference UWBT8038