| SpectraBase Compound ID | 32wykhAhrZA |
|---|---|
| InChI | InChI=1S/C27H44O6/c1-15(6-9-24(31)32-5)19-7-8-20-25-21(14-23(30)27(19,20)4)26(3)11-10-18(33-16(2)28)12-17(26)13-22(25)29/h15,17-23,25,29-30H,6-14H2,1-5H3/t15?,17?,18-,19-,20?,21?,22-,23+,25?,26+,27-/m0/s1 |
| InChIKey | RYUNWMNMODIREU-XEQDDHESSA-N |
| Mol Weight | 464.6 g/mol |
| Molecular Formula | C27H44O6 |
| Exact Mass | 464.313789 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1SOMmVII2E |
|---|---|
| Name | 3A-ACETYLOXY-7A,12A-DIHYDROXY-5B-CHOLAN-24-OATE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C27H44O6 |
| InChI | InChI=1S/C27H44O6/c1-15(6-9-24(31)32-5)19-7-8-20-25-21(14-23(30)27(19,20)4)26(3)11-10-18(33-16(2)28)12-17(26)13-22(25)29/h15,17-23,25,29-30H,6-14H2,1-5H3/t15?,17?,18-,19-,20?,21?,22-,23+,25?,26+,27-/m0/s1 |
| InChIKey | RYUNWMNMODIREU-XEQDDHESSA-N |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |