![20-(17->18)-ABEO-3-(TERT.-BUTYLDIMETHYLSILYL)-1-ALPHA-[(TERT.-BUTYLDIMETHYLSILYL)-OXY]-25-HYDROXY-22-HOMO-21-NORVITAMIN-D3](/api/spectrum/KkhfrvNZSU1/structure.png?h=300&w=458 "20-(17->18)-ABEO-3-(TERT.-BUTYLDIMETHYLSILYL)-1-ALPHA-[(TERT.-BUTYLDIMETHYLSILYL)-OXY]-25-HYDROXY-22-HOMO-21-NORVITAMIN-D3")
| SpectraBase Compound ID | DQUvDVxm3i5 |
|---|---|
| InChI | InChI=1S/C39H72O3Si2/c1-30-32(28-33(41-43(10,11)36(2,3)4)29-35(30)42-44(12,13)37(5,6)7)23-22-31-20-18-26-39(27-19-21-34(31)39)25-17-15-14-16-24-38(8,9)40/h22-23,33-35,40H,1,14-21,24-29H2,2-13H3/b31-22+,32-23-/t33-,34+,35+,39-/m1/s1 |
| InChIKey | DFXBADZMLBQYLQ-QHROYQSWSA-N |
| Mol Weight | 645.2 g/mol |
| Molecular Formula | C39H72O3Si2 |
| Exact Mass | 644.501999 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KkhfrvNZSU1 |
|---|---|
| Name | 20-(17->18)-ABEO-3-(TERT.-BUTYLDIMETHYLSILYL)-1-ALPHA-[(TERT.-BUTYLDIMETHYLSILYL)-OXY]-25-HYDROXY-22-HOMO-21-NORVITAMIN-D3 |
| Compound Number | 44B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H72O3Si2 |
| InChI | InChI=1S/C39H72O3Si2/c1-30-32(28-33(41-43(10,11)36(2,3)4)29-35(30)42-44(12,13)37(5,6)7)23-22-31-20-18-26-39(27-19-21-34(31)39)25-17-15-14-16-24-38(8,9)40/h22-23,33-35,40H,1,14-21,24-29H2,2-13H3/b31-22+,32-23-/t33-,34+,35+,39-/m1/s1 |
| InChIKey | DFXBADZMLBQYLQ-QHROYQSWSA-N |
| Literature Reference Author | E.MOMAN,D.NICOLETTI,A.MOURINO |
| Literature Reference Citation | J.ORG.CHEM.,69,4615(2004) |
| Literature Reference DOI | 10.1021/jo0498664 |
| Molecular Weight | 645.170 g/mol |
| Solvent | CD2Cl2 |
| Source File Reference | UWVN21989 |