| SpectraBase Compound ID | 15wGvNEnx4X |
|---|---|
| InChI | InChI=1S/C29H50O5/c1-20(8-5-14-28(2,3)33)23-12-13-24-22(9-6-15-29(23,24)4)11-10-21-18-25(31)27(26(32)19-21)34-17-7-16-30/h10-11,20,23-27,30-33H,5-9,12-19H2,1-4H3/b21-10-,22-11+/t20-,23?,24?,25-,26-,27?,29-/m1/s1 |
| InChIKey | SGILNBMDWGBSLS-IFNWGYGKSA-N |
| Mol Weight | 478.7 g/mol |
| Molecular Formula | C29H50O5 |
| Exact Mass | 478.365825 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6S34rIVTN5c |
|---|---|
| Name | 2.alpha.-(3'-Hydroxypropoxy)-1.alpha.,25-dihydroxy-19-norvitamin D3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H50O5 |
| InChI | InChI=1S/C29H50O5/c1-20(8-5-14-28(2,3)33)23-12-13-24-22(9-6-15-29(23,24)4)11-10-21-18-25(31)27(26(32)19-21)34-17-7-16-30/h10-11,20,23-27,30-33H,5-9,12-19H2,1-4H3/b21-10-,22-11+/t20-,23?,24?,25-,26-,27?,29-/m1/s1 |
| InChIKey | SGILNBMDWGBSLS-IFNWGYGKSA-N |
| Molecular Weight | 478.714 g/mol |
| SMILES | O[C@@]1(CC(C[C@](C1OCCCO)(O)[H])=C\C=C\1C2[C@@](C(CC2)[C@@](CCCC(O)(C)C)(C)[H])(CCC1)C)[H] |
| SPLASH | splash10-05mk-9010200000-999d6009ff76a363906e |
| Source of Spectrum | E1-37-3737-17 |
| Synonyms | 2.beta.-(3'-Hydroxypropoxy)-1.alpha.,25-dihydroxy-19-norvitamin D3 |
| Wiley ID | 1575390 |