| SpectraBase Compound ID | 3En0NEVgXVu |
|---|---|
| InChI | InChI=1S/C43H61FO3Si/c1-31(16-14-26-42(5,6)46)38-24-25-39-32(17-15-27-43(38,39)7)22-23-33-28-34(45)29-40(37(33)30-44)47-48(41(2,3)4,35-18-10-8-11-19-35)36-20-12-9-13-21-36/h8-13,18-23,30-31,34,38-40,45-46H,14-17,24-29H2,1-7H3/b32-22+,33-23-,37-30-/t31-,34+,38-,39?,40+,43?/m0/s1 |
| InChIKey | KDMINOAEZLBQJS-PLLPKGGMSA-N |
| Mol Weight | 673.0 g/mol |
| Molecular Formula | C43H61FO3Si |
| Exact Mass | 672.437401 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LLvhJEpTgtD |
|---|---|
| Name | (10Z)-19-FLUORO-1-ALPHA,25-DIHYDROXY-VITAMIN-D3-1-TERT.-BUTYLDIPHENYLSILYLETHER |
| Compound Number | 22B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H61FO3Si |
| InChI | InChI=1S/C43H61FO3Si/c1-31(16-14-26-42(5,6)46)38-24-25-39-32(17-15-27-43(38,39)7)22-23-33-28-34(45)29-40(37(33)30-44)47-48(41(2,3)4,35-18-10-8-11-19-35)36-20-12-9-13-21-36/h8-13,18-23,30-31,34,38-40,45-46H,14-17,24-29H2,1-7H3/b32-22+,33-23-,37-30-/t31-,34+,38-,39?,40+,43?/m0/s1 |
| InChIKey | KDMINOAEZLBQJS-PLLPKGGMSA-N |
| Literature Reference Author | M.SHIMIZU,A.OHNO,S.YAMADA |
| Literature Reference Citation | CHEM.PHARM.BULL.,49,312(2001) |
| Literature Reference DOI | 10.1248/cpb.49.312 |
| Solvent | CDCl3 |
| Source File Reference | UWVN28988 |