| SpectraBase Compound ID | aDVwm8rz7P |
|---|---|
| InChI | InChI=1S/C40H50O15P2/c1-44-28-47-36-35(41)37(48-29-45-2)39(54-56(42,50-24-31-16-8-4-9-17-31)51-25-32-18-10-5-11-19-32)40(38(36)49-30-46-3)55-57(43,52-26-33-20-12-6-13-21-33)53-27-34-22-14-7-15-23-34/h4-23,35-41H,24-30H2,1-3H3/t35-,36+,37+,38+,39-,40-/m1/s1 |
| InChIKey | XWZPFQKYRRJSAL-AABJGKTFSA-N |
| Mol Weight | 832.8 g/mol |
| Molecular Formula | C40H50O15P2 |
| Exact Mass | 832.262495 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J5AXehRmvhe |
|---|---|
| Name | 1D-O-2,3,6-O-TRIS-(METHOXYMETHYLENE)-MYO-INOSITOL-4,5-BIS-(DIBENZYLPHOSPHATE) |
| Compound Number | 67 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H50O15P2 |
| InChI | InChI=1S/C40H50O15P2/c1-44-28-47-36-35(41)37(48-29-45-2)39(54-56(42,50-24-31-16-8-4-9-17-31)51-25-32-18-10-5-11-19-32)40(38(36)49-30-46-3)55-57(43,52-26-33-20-12-6-13-21-33)53-27-34-22-14-7-15-23-34/h4-23,35-41H,24-30H2,1-3H3/t35-,36+,37+,38+,39-,40-/m1/s1 |
| InChIKey | XWZPFQKYRRJSAL-AABJGKTFSA-N |
| Literature Reference Author | R.J.KUBIAK,K.S.BRUZIK |
| Literature Reference Citation | J.ORG.CHEM.,68,960(2003) |
| Literature Reference DOI | 10.1021/jo0206418 |
| Solvent | CDCl3 |
| Source File Reference | UWLU22880 |