| SpectraBase Compound ID | 856UDVB3QS7 |
|---|---|
| InChI | InChI=1S/C35H54O/c1-22(2)26-15-18-35(9,29-13-11-24(5)19-28(26)29)36-31-21-30-25(20-27(31)23(3)4)12-14-32-33(6,7)16-10-17-34(30,32)8/h19-23,26,28-29,32H,10-18H2,1-9H3/t26-,28-,29+,32-,34+,35+/m0/s1 |
| InChIKey | PUOUOSYFDPLSOP-TYEQMGJPSA-N |
| Mol Weight | 490.8 g/mol |
| Molecular Formula | C35H54O |
| Exact Mass | 490.417466 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2isyxwPwM8g |
|---|---|
| Name | CALODIMER_B;ABIETA-8,11-13-TRIEN-12-YL_ALPHA-CADINE-10-YL_ETHER |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H54O |
| InChI | InChI=1S/C35H54O/c1-22(2)26-15-18-35(9,29-13-11-24(5)19-28(26)29)36-31-21-30-25(20-27(31)23(3)4)12-14-32-33(6,7)16-10-17-34(30,32)8/h19-23,26,28-29,32H,10-18H2,1-9H3/t26-,28-,29+,32-,34+,35+/m0/s1 |
| InChIKey | PUOUOSYFDPLSOP-TYEQMGJPSA-N |
| Literature Reference Author | C.L.HSIEH,L.L.SHIU,M.H.TSENG,Y.Y.SHAO,Y.H.KUO |
| Literature Reference Citation | J.NAT.PROD.,69,665(2006) |
| Literature Reference DOI | 10.1021/np058090e |
| Molecular Weight | 490.813 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ18286 |