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(-)-2,4,6-TRI-O-BENZYL-MYO-INOSITOL-1-PHOSPHATE

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(-)-2,4,6-TRI-O-BENZYL-MYO-INOSITOL-1-PHOSPHATE
SpectraBase Compound ID I3zFFMInLT0
InChI InChI=1S/C39H39O9P/c40-34-36(43-26-29-16-6-1-7-17-29)35(41)38(45-28-31-20-10-3-11-21-31)39(37(34)44-27-30-18-8-2-9-19-30)48-49(42,46-32-22-12-4-13-23-32)47-33-24-14-5-15-25-33/h1-25,34-41H,26-28H2/t34-,35+,36-,37-,38-,39-/m0/s1
InChIKey BYMRGMPKVJMPKI-MVZBGDKDSA-N
Mol Weight 682.7 g/mol
Molecular Formula C39H39O9P
Exact Mass 682.23317 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2U2BQSrE8zu
Name (-)-2,4,6-TRI-O-BENZYL-MYO-INOSITOL-1-PHOSPHATE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H39O9P
InChI InChI=1S/C39H39O9P/c40-34-36(43-26-29-16-6-1-7-17-29)35(41)38(45-28-31-20-10-3-11-21-31)39(37(34)44-27-30-18-8-2-9-19-30)48-49(42,46-32-22-12-4-13-23-32)47-33-24-14-5-15-25-33/h1-25,34-41H,26-28H2/t34-,35+,36-,37-,38-,39-/m0/s1
InChIKey BYMRGMPKVJMPKI-MVZBGDKDSA-N
Literature Reference Author B.R.SCULIMBRENE,S.J.MILLER
Literature Reference Citation J.AM.CHEM.SOC.,123,10125(2001)
Literature Reference DOI 10.1021/ja016779+
Solvent CDCl3
Source File Reference UWLU32584