| SpectraBase Compound ID | G5xehHpN7gD |
|---|---|
| InChI | InChI=1S/C25H42O3/c1-17-12-13-20(18(2)23(17)11-6-7-14-25(4,5)28)9-8-10-21-15-22(26)16-24(27)19(21)3/h8-10,17-18,20,22-24,26-28H,3,6-7,11-16H2,1-2,4-5H3/b9-8+,21-10-/t17-,18+,20-,22-,23+,24+/m1/s1 |
| InChIKey | AMNDOSXFNGLJDW-HLYRMMPDSA-N |
| Mol Weight | 390.6 g/mol |
| Molecular Formula | C25H42O3 |
| Exact Mass | 390.313395 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2DITlvEU39G |
|---|---|
| Name | 1.alpha.,25-Dihydrox-8,9-seco-C-nor-21-nor-15-homovitamin D3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H42O3 |
| InChI | InChI=1S/C25H42O3/c1-17-12-13-20(18(2)23(17)11-6-7-14-25(4,5)28)9-8-10-21-15-22(26)16-24(27)19(21)3/h8-10,17-18,20,22-24,26-28H,3,6-7,11-16H2,1-2,4-5H3/b9-8+,21-10-/t17-,18+,20-,22-,23+,24+/m1/s1 |
| InChIKey | AMNDOSXFNGLJDW-HLYRMMPDSA-N |
| Molecular Weight | 390.608 g/mol |
| SMILES | O[C@]1(C[C@@](C\C(C1=C)=C/C=C/[C@]1([C@@]([C@@](CCCCC(O)(C)C)([C@@](CC1)(C)[H])[H])(C)[H])[H])(O)[H])[H] |
| SPLASH | splash10-002f-9702000000-64edc0b871f4848e6b37 |
| Source of Spectrum | QE-7-530-4 |
| Wiley ID | 845292 |