| SpectraBase Compound ID | FE2ZihJNJYA |
|---|---|
| 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-ZMEUZFOOSA-N |
| Mol Weight | 430.6 g/mol |
| Molecular Formula | C27H42O4 |
| Exact Mass | 430.30831 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Th8LrTZ0um |
|---|---|
| Name | 3-EPIRUSCOGENIN;(25R)-SPIROST-5-EN-1-BETA,3-ALPHA-DIOL |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. 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-ZMEUZFOOSA-N |
| Literature Reference Author | W.B.PAN,F.R.CHANG,L.M.WEI,Y.C.WU |
| Literature Reference Citation | J.NAT.PROD.,66,161(2003) |
| Literature Reference DOI | 10.1021/np0203382 |
| Molecular Weight | 430.628 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWSI4455 |