| SpectraBase Compound ID | KpCOTErQUZn |
|---|---|
| InChI | InChI=1S/C25H42O4/c1-19(2)11-8-12-20(3)13-9-14-21(4)15-10-17-25(6)18-16-23(28-29-25)22(5)24(26)27-7/h11,13,15,22-23H,8-10,12,14,16-18H2,1-7H3/b20-13+,21-15+/t22-,23-,25+/m0/s1 |
| InChIKey | LCYOYORSUQYOEM-BIPLRLLMSA-N |
| Mol Weight | 406.6 g/mol |
| Molecular Formula | C25H42O4 |
| Exact Mass | 406.30831 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1zFfnvbwAOJ |
|---|---|
| Name | SIGMOSCEPTRELLIN_E_METHYLESTER |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H42O4 |
| InChI | InChI=1S/C25H42O4/c1-19(2)11-8-12-20(3)13-9-14-21(4)15-10-17-25(6)18-16-23(28-29-25)22(5)24(26)27-7/h11,13,15,22-23H,8-10,12,14,16-18H2,1-7H3/b20-13+,21-15+/t22-,23-,25+/m0/s1 |
| InChIKey | LCYOYORSUQYOEM-BIPLRLLMSA-N |
| Literature Reference Author | S.P.B.OVENDEN,R.J.CAPON |
| Literature Reference Citation | J.NAT.PROD.,62,214(1999) |
| Literature Reference DOI | 10.1021/np980223r |
| Molecular Weight | 406.606 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ2654 |