SpectraBase Compound ID | E8rICKliQIL |
---|---|
InChI | InChI=1S/C27H44O7/c1-15(6-9-23(30)32-4)18-7-8-19-24-20(14-22(29)27(18,19)3)26(2)11-10-17(34-25(31)33-5)12-16(26)13-21(24)28/h15-22,24,28-29H,6-14H2,1-5H3/t15-,16+,17-,18-,19+,20+,21-,22+,24+,26+,27-/m1/s1 |
InChIKey | RFZCMKPXTUDQSE-ZESNAWOTSA-N |
Mol Weight | 480.6 g/mol |
Molecular Formula | C27H44O7 |
Exact Mass | 480.308704 g/mol |
SpectraBase Spectrum ID | HUzAJTjZiEi |
---|---|
Name | Cholic acid, methyl ester, 3-(methyl carbonate) |
Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C27H44O7 |
InChI | InChI=1S/C27H44O7/c1-15(6-9-23(30)32-4)18-7-8-19-24-20(14-22(29)27(18,19)3)26(2)11-10-17(34-25(31)33-5)12-16(26)13-21(24)28/h15-22,24,28-29H,6-14H2,1-5H3/t15-,16+,17-,18-,19+,20+,21-,22+,24+,26+,27-/m1/s1 |
InChIKey | RFZCMKPXTUDQSE-ZESNAWOTSA-N |
Instrument Name | Varian CFT-20 |
Sadtler NMR Number | 52961M |
Solvent | CDCl3 |