| SpectraBase Compound ID | DhCo6wPEx8 |
|---|---|
| InChI | InChI=1S/C25H41N3O3/c1-15(5-10-23(30)31-4)19-8-9-20-18-7-6-16-13-17(27-28-26)11-12-24(16,2)21(18)14-22(29)25(19,20)3/h15-22,29H,5-14H2,1-4H3/t15-,16-,17-,18+,19-,20+,21+,22+,24+,25-/m1/s1 |
| InChIKey | ZZLPBWPJJAQPCQ-JMKDMENQSA-N |
| Mol Weight | 431.6 g/mol |
| Molecular Formula | C25H41N3O3 |
| Exact Mass | 431.314792 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KsVNId96Huj |
|---|---|
| Name | METHYL-3-ALPHA-AZIDO,12-ALPHA-HYDROXY-5-BETA-CHOLAN-24-OATE |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H41N3O3 |
| InChI | InChI=1S/C25H41N3O3/c1-15(5-10-23(30)31-4)19-8-9-20-18-7-6-16-13-17(27-28-26)11-12-24(16,2)21(18)14-22(29)25(19,20)3/h15-22,29H,5-14H2,1-4H3/t15-,16-,17-,18+,19-,20+,21+,22+,24+,25-/m1/s1 |
| InChIKey | ZZLPBWPJJAQPCQ-JMKDMENQSA-N |
| Literature Reference Author | D.VERZELE,S.FIGAROLI,A.MADDER |
| Literature Reference Citation | MOLECULES,16,10168(2011) |
| Literature Reference DOI | 10.3390/molecules161210168 |
| Molecular Weight | 431.619 g/mol |
| Sample ID | 478 |
| Solvent | CDCl3 |