| SpectraBase Compound ID | GUCQypmOYqR |
|---|---|
| InChI | InChI=1S/C30H52O3/c1-17(2)20(18(3)4)9-8-19(5)22-10-11-23-21-14-26(31)25-15-27(32)28(33)16-30(25,7)24(21)12-13-29(22,23)6/h8-9,17-28,31-33H,10-16H2,1-7H3/b9-8-/t19-,21+,22-,23+,24+,25-,26+,27+,28+,29-,30-/m1/s1 |
| InChIKey | MGKVYQJGHXHGTN-OHVGJZEWSA-N |
| Mol Weight | 460.7 g/mol |
| Molecular Formula | C30H52O3 |
| Exact Mass | 460.391646 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4E4AvHpSifT |
|---|---|
| Name | TOPSENTINOL_K |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H52O3 |
| InChI | InChI=1S/C30H52O3/c1-17(2)20(18(3)4)9-8-19(5)22-10-11-23-21-14-26(31)25-15-27(32)28(33)16-30(25,7)24(21)12-13-29(22,23)6/h8-9,17-28,31-33H,10-16H2,1-7H3/b9-8-/t19-,21+,22-,23+,24+,25-,26+,27+,28+,29-,30-/m1/s1 |
| InChIKey | MGKVYQJGHXHGTN-OHVGJZEWSA-N |
| Literature Reference Author | J.DAI,A.SORRIBAS,W.Y.YOSHIDA,M.KELLY,P.G.WILLIAMS |
| Literature Reference Citation | J.NAT.PROD.,73,1597(2010) |
| Literature Reference DOI | 10.1021/np100374b |
| Molecular Weight | 460.741 g/mol |
| Sample ID | 36194 |
| Solvent | CD3OD |