| SpectraBase Compound ID | BDQAUKTKA7O |
|---|---|
| InChI | InChI=1S/C27H44O5/c1-14-9-23(30)27(31-13-14)15(2)24-22(32-27)12-19-17-11-21(29)20-10-16(28)5-7-25(20,3)18(17)6-8-26(19,24)4/h14-24,28-30H,5-13H2,1-4H3/t14?,15-,16-,17?,18?,19?,20?,21?,22?,23?,24?,25+,26-,27?/m0/s1 |
| InChIKey | GDFVLFBHNREYBP-XANJEOKNSA-N |
| Mol Weight | 448.6 g/mol |
| Molecular Formula | C27H44O5 |
| Exact Mass | 448.318875 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7FxyPVUsXxb |
|---|---|
| Name | Hainangenin |
| Alternate Name(s) | (3beta)-spirostan-3,6,23-triol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H44O5 |
| InChI | InChI=1S/C27H44O5/c1-14-9-23(30)27(31-13-14)15(2)24-22(32-27)12-19-17-11-21(29)20-10-16(28)5-7-25(20,3)18(17)6-8-26(19,24)4/h14-24,28-30H,5-13H2,1-4H3/t14?,15-,16-,17?,18?,19?,20?,21?,22?,23?,24?,25+,26-,27?/m0/s1 |
| InChIKey | GDFVLFBHNREYBP-XANJEOKNSA-N |
| Molecular Weight | 448.644 g/mol |
| SMILES | O[C@@]1(CC2[C@@](C3CC[C@@]4(C5[C@@](C6(OC5CC4C3CC2O)OCC(CC6O)C)(C)[H])C)(CC1)C)[H] |
| SPLASH | splash10-03ds-9468000000-5c06a7f926b03f654c96 |
| Source of Spectrum | SI-34-183-4 |
| Wiley ID | 1387289 |