| SpectraBase Compound ID | J0o4eP6I7XY |
|---|---|
| InChI | InChI=1S/C29H48O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-17-27(31)26-16-21(30)12-14-29(26,6)25(22)13-15-28(23,24)5/h8-9,16,18-25,27,30-31H,7,10-15,17H2,1-6H3/b9-8+/t19-,20-,21+,22+,23-,24+,25+,27-,28?,29?/m1/s1 |
| InChIKey | YLQCVNVIULEHRQ-HSVVGEKUSA-N |
| Mol Weight | 428.7 g/mol |
| Molecular Formula | C29H48O2 |
| Exact Mass | 428.365431 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GydUuXxZwvV |
|---|---|
| Name | STIGMASTA-4,22-DIENE-3-BETA,6-BETA-DIOL |
| Compound Number | 9B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H48O2 |
| InChI | InChI=1S/C29H48O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-17-27(31)26-16-21(30)12-14-29(26,6)25(22)13-15-28(23,24)5/h8-9,16,18-25,27,30-31H,7,10-15,17H2,1-6H3/b9-8+/t19-,20-,21+,22+,23-,24+,25+,27-,28?,29?/m1/s1 |
| InChIKey | YLQCVNVIULEHRQ-HSVVGEKUSA-N |
| Literature Reference Author | O.M.T.CENTURION,L.R.GALAGOVSKY,E.G.GROS |
| Literature Reference Citation | STEROIDS,60,434(1995) |
| Literature Reference DOI | 10.1016/0039-128x(95)00032-l |
| Molecular Weight | 428.699 g/mol |
| Source File Reference | UWLU73836 |