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DIMETHYL_(3-S)-2-[(((3-(N-BENZYLOXYCARBONYL)-AMINO-3-METHOXYCARBONYL)-PROPYL)-(HYDROXY)-PHOSPHINYL)-METHYL]-BUTAN-1,4-DIOATE

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DIMETHYL_(3-S)-2-[(((3-(N-BENZYLOXYCARBONYL)-AMINO-3-METHOXYCARBONYL)-PROPYL)-(HYDROXY)-PHOSPHINYL)-METHYL]-BUTAN-1,4-DIOATE
SpectraBase Compound ID AfyBxoNpBxy
InChI InChI=1S/C20H28NO10P/c1-28-17(22)11-15(18(23)29-2)13-32(26,27)10-9-16(19(24)30-3)21-20(25)31-12-14-7-5-4-6-8-14/h4-8,15-16H,9-13H2,1-3H3,(H,21,25)(H,26,27)/t15?,16-/m0/s1
InChIKey PCAACIDDDNRBNQ-LYKKTTPLSA-N
Mol Weight 473.41 g/mol
Molecular Formula C20H28NO10P
Exact Mass 473.145083 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FcgeiebkkSX
Name DIMETHYL_(3-S)-2-[(((3-(N-BENZYLOXYCARBONYL)-AMINO-3-METHOXYCARBONYL)-PROPYL)-(HYDROXY)-PHOSPHINYL)-METHYL]-BUTAN-1,4-DIOATE
Compound Number 52
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H27NO10P
InChI InChI=1S/C20H28NO10P/c1-28-17(22)11-15(18(23)29-2)13-32(26,27)10-9-16(19(24)30-3)21-20(25)31-12-14-7-5-4-6-8-14/h4-8,15-16H,9-13H2,1-3H3,(H,21,25)(H,26,27)/t15?,16-/m0/s1
InChIKey PCAACIDDDNRBNQ-LYKKTTPLSA-N
Literature Reference Author C.SELVAM,N.OUESLATI,I.A.LEMASSON,I.BRABER,D.RIGAULT,T.COURTI OL,S.CESARINI,N.TRIB
Literature Reference Citation J.MED.CHEM.,53,2797(2010)
Literature Reference DOI 10.1021/jm901523t
Solvent CD3OD
Source File Reference UWMZ46452