| SpectraBase Compound ID | H59g7ypMBdq |
|---|---|
| InChI | InChI=1S/C27H42O4/c1-15-7-10-27(30-14-15)16(2)24-22(31-27)13-21-19-6-5-17-11-18(28)12-23(29)26(17,4)20(19)8-9-25(21,24)3/h5,15-16,18-24,28-29H,6-14H2,1-4H3/t15?,16-,18?,19?,20?,21?,22?,23?,24?,25-,26-,27+/m0/s1 |
| InChIKey | QMQIQBOGXYYATH-RHZWSCSLSA-N |
| Mol Weight | 430.6 g/mol |
| Molecular Formula | C27H42O4 |
| Exact Mass | 430.30831 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HGfFfGPX8Y4 |
|---|---|
| Name | (25S)-Roscogenin |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H42O4 |
| InChI | InChI=1S/C27H42O4/c1-15-7-10-27(30-14-15)16(2)24-22(31-27)13-21-19-6-5-17-11-18(28)12-23(29)26(17,4)20(19)8-9-25(21,24)3/h5,15-16,18-24,28-29H,6-14H2,1-4H3/t15?,16-,18?,19?,20?,21?,22?,23?,24?,25-,26-,27+/m0/s1 |
| InChIKey | QMQIQBOGXYYATH-RHZWSCSLSA-N |
| Molecular Weight | 430.629 g/mol |
| SMILES | OC1CC2=CCC3C4[C@](CCC3[C@]2(C(C1)O)C)(C1[C@@]([C@@]2(OC1C4)OCC(CC2)C)(C)[H])C |
| SPLASH | splash10-000i-0900100000-fb38a49896e624fa756d |
| Source of Spectrum | X4-58-781-2 |
| Wiley ID | 1605889 |