| SpectraBase Compound ID | JnNvlG5qJHT |
|---|---|
| InChI | InChI=1S/C29H46O2/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/h16,18-20,22-25H,7-15,17H2,1-6H3/t19-,20+,22+,23-,24+,25+,28-,29-/m1/s1 |
| InChIKey | UVFOCYGYACXLAY-CCBZTEDDSA-N |
| Mol Weight | 426.7 g/mol |
| Molecular Formula | C29H46O2 |
| Exact Mass | 426.349781 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ELMJbG8oFDo |
|---|---|
| Name | STIGMAST-4-ENE-3,6-DIONE |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H46O2 |
| InChI | InChI=1S/C29H46O2/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/h16,18-20,22-25H,7-15,17H2,1-6H3/t19-,20+,22+,23-,24+,25+,28-,29-/m1/s1 |
| InChIKey | UVFOCYGYACXLAY-CCBZTEDDSA-N |
| Literature Reference Author | M.D.GRECA,P.MONACO,L.PREVITERA |
| Literature Reference Citation | J.NAT.PROD.,53,1430(1990) |
| Literature Reference DOI | 10.1021/np50072a005 |
| Molecular Weight | 426.683 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS23610 |