| SpectraBase Compound ID | HmqyCdOcckk |
|---|---|
| InChI | InChI=1S/C30H46O3/c1-19(8-13-26(22-9-10-22)29(3,4)33)25-14-15-27-21(7-6-16-30(25,27)5)11-12-23-17-24(31)18-28(32)20(23)2/h8,11-13,19,22,24-28,31-33H,2,6-7,9-10,14-18H2,1,3-5H3/b13-8+,21-11+,23-12+/t19-,24?,25-,26-,27+,28-,30-/m1/s1 |
| InChIKey | SYXCOPZGNIKPGR-CUWJYCQQSA-N |
| Mol Weight | 454.7 g/mol |
| Molecular Formula | C30H46O3 |
| Exact Mass | 454.344695 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gk9vn9cmTKe |
|---|---|
| Name | (24S)-24-CYCLOPROPYL-1-ALPHA,25-DIHYDROXY-28-NORVITAMIN_D2 |
| Compound Number | 19C |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O3 |
| InChI | InChI=1S/C30H46O3/c1-19(8-13-26(22-9-10-22)29(3,4)33)25-14-15-27-21(7-6-16-30(25,27)5)11-12-23-17-24(31)18-28(32)20(23)2/h8,11-13,19,22,24-28,31-33H,2,6-7,9-10,14-18H2,1,3-5H3/b13-8+,21-11+,23-12+/t19-,24?,25-,26-,27+,28-,30-/m1/s1 |
| InChIKey | SYXCOPZGNIKPGR-CUWJYCQQSA-N |
| Literature Reference Author | M.TORNEIRO,Y.FALL,L.CASTEDO,A.MOURINO |
| Literature Reference Citation | J.ORG.CHEM.,62,6344(1997) |
| Literature Reference DOI | 10.1021/jo970604u |
| Molecular Weight | 454.693 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ4436 |