| SpectraBase Compound ID | AJv6nrk1TLZ |
|---|---|
| InChI | InChI=1S/2C29H43NO4/c2*1-17(25-16-26(34-30-25)27(3,4)32)22-9-10-23-21-8-7-19-15-20(33-18(2)31)11-13-28(19,5)24(21)12-14-29(22,23)6/h2*7-8,17,20,22-24,26,32H,9-16H2,1-6H3/t17-,20-,22+,23-,24-,26?,28-,29+;17-,20-,22-,23-,24-,26?,28-,29+/m00/s1 |
| InChIKey | ULLIRCSIKLOTIB-IWDIFMDLSA-N |
| Mol Weight | 939.3 g/mol |
| Molecular Formula | C58H86N2O8 |
| Exact Mass | 938.638418 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 506kXU8tjYT |
|---|---|
| Name | MIXTURE;(5'-XI)-3-BETA-ACETOXY-20-(5'-HYDROXYISOPROPYL-3'-ISOXAZOLINYL)-PREGNA-5,7-DIENE |
| Compound Number | IX |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C58H86N2O8 |
| InChI | InChI=1S/2C29H43NO4/c2*1-17(25-16-26(34-30-25)27(3,4)32)22-9-10-23-21-8-7-19-15-20(33-18(2)31)11-13-28(19,5)24(21)12-14-29(22,23)6/h2*7-8,17,20,22-24,26,32H,9-16H2,1-6H3/t17-,20-,22+,23-,24-,26?,28-,29+;17-,20-,22-,23-,24-,26?,28-,29+/m00/s1 |
| InChIKey | ULLIRCSIKLOTIB-IWDIFMDLSA-N |
| Literature Reference Author | R.P.LITVINOVSKAYA,N.V.KOVAL,V.A.KHRIPACH |
| Literature Reference Citation | CHEM.HET.COMP.,34,241(1998) |
| Literature Reference DOI | 10.1007/bf02315192 |
| Molecular Weight | 939.329 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ14483 |