| SpectraBase Compound ID | 7ZB8heKM0YN |
|---|---|
| InChI | InChI=1S/C27H42O4/c1-16-7-12-26(30-15-16)17(2)27(29)23(31-26)14-22-20-6-5-18-13-19(28)8-10-24(18,3)21(20)9-11-25(22,27)4/h5,16-17,19-23,28-29H,6-15H2,1-4H3/t16-,17+,19-,20+,21-,22-,23-,24-,25-,26+,27+/m0/s1 |
| InChIKey | SYYHBUHOUUETMI-SZMLHDHVSA-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 | 3gBYY7xc6fd |
|---|---|
| Name | PENNOGENIN=(25R)-5-SPIROSTEN-3-BETA,17-ALPHA-DIOL |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H42O4 |
| InChI | InChI=1S/C27H42O4/c1-16-7-12-26(30-15-16)17(2)27(29)23(31-26)14-22-20-6-5-18-13-19(28)8-10-24(18,3)21(20)9-11-25(22,27)4/h5,16-17,19-23,28-29H,6-15H2,1-4H3/t16-,17+,19-,20+,21-,22-,23-,24-,25-,26+,27+/m0/s1 |
| InChIKey | SYYHBUHOUUETMI-SZMLHDHVSA-N |
| Literature Reference Author | O.ESPEJO,J.C.LLAVOT,H.JUNG,F.GIRAL |
| Literature Reference Citation | PHYTOCHEM.,21,413(1982) |
| Literature Reference DOI | 10.1016/S0031-9422(00)95278-6 |
| Molecular Weight | 430.628 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UNIW17111 |