| SpectraBase Compound ID | 4PQ0gibo3Oq |
|---|---|
| InChI | InChI=1S/C29H46O6/c1-17(7-10-26(32)33-6)22-8-9-23-27-24(12-14-29(22,23)5)28(4)13-11-21(34-18(2)30)15-20(28)16-25(27)35-19(3)31/h17,20-25,27H,7-16H2,1-6H3/t17-,20+,21-,22-,23+,24+,25-,27+,28+,29-/m1/s1 |
| InChIKey | ZKHVKSAMEUAGEN-JSWGAMEVSA-N |
| Mol Weight | 490.7 g/mol |
| Molecular Formula | C29H46O6 |
| Exact Mass | 490.329439 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9JDxlqQWlPD |
|---|---|
| Name | 3α,7α-dihydroxy-5β-cholan-24-oic acid, methyl ester, diacetate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H46O6 |
| InChI | InChI=1S/C29H46O6/c1-17(7-10-26(32)33-6)22-8-9-23-27-24(12-14-29(22,23)5)28(4)13-11-21(34-18(2)30)15-20(28)16-25(27)35-19(3)31/h17,20-25,27H,7-16H2,1-6H3/t17-,20+,21-,22-,23+,24+,25-,27+,28+,29-/m1/s1 |
| InChIKey | ZKHVKSAMEUAGEN-JSWGAMEVSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 26721M |
| Solvent | CDCl3 |