| SpectraBase Spectrum ID |
5dqM2oln8KJ |
| Name |
2-methylene-1.alpha.,25-dihydroxy-19,21-dinorvitamin D3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H42O3 |
| InChI |
InChI=1S/C26H42O3/c1-18-23(27)16-19(17-24(18)28)10-11-20-8-7-15-26(4)21(12-13-22(20)26)9-5-6-14-25(2,3)29/h10-11,21-24,27-29H,1,5-9,12-17H2,2-4H3/b20-11+/t21-,22-,23+,24+,26+/m0/s1 |
| InChIKey |
VQZPGRFOOZNFEY-XWVXGHASSA-N |
| Ionization Type |
EI |
| Molecular Weight |
402.619 g/mol |
| Optical Rotation |
[a]D = +8.0 (c = 0.80, CHCl3) |
| SMILES |
O[C@]1(C([C@@](CC(C1)=C\C=C/1CCC[C@@]2([C@](CC[C@@]12[H])(CCCCC(C)(C)O)[H])C)(O)[H])=C)[H] |
| SPLASH |
splash10-0005-9210100000-84b767fc15099adb3dc7 |
| Source of Spectrum |
US7648973B2 |
| Wiley ID |
1842506 |
