| SpectraBase Compound ID | 36fMFT3aLmW |
|---|---|
| InChI | InChI=1S/C33H40O5/c1-19(2)14-16-31-18-22-23(25-30(7,8)38-25)32(26(31)35,17-15-20(3)4)28(37)33(27(31)36,29(22,5)6)24(34)21-12-10-9-11-13-21/h9-15,22-23,25H,16-18H2,1-8H3/t22-,23-,25-,31+,32-,33+/m1/s1 |
| InChIKey | CVRGNVXISHMROR-XROPJDIDSA-N |
| Mol Weight | 516.7 g/mol |
| Molecular Formula | C33H40O5 |
| Exact Mass | 516.287574 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Cgyj7GaCbtb |
|---|---|
| Name | SAMPSONIONE_Q |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H40O5 |
| InChI | InChI=1S/C33H40O5/c1-19(2)14-16-31-18-22-23(25-30(7,8)38-25)32(26(31)35,17-15-20(3)4)28(37)33(27(31)36,29(22,5)6)24(34)21-12-10-9-11-13-21/h9-15,22-23,25H,16-18H2,1-8H3/t22-,23-,25-,31+,32-,33+/m1/s1 |
| InChIKey | CVRGNVXISHMROR-XROPJDIDSA-N |
| Literature Reference Author | Z.Y.XIAO,Q.MU,W.K.P.SHIU,Y.H.ZENG,S.GIBBONS |
| Literature Reference Citation | J.NAT.PROD.,70,1779(2007) |
| Literature Reference DOI | 10.1021/np0704147 |
| Molecular Weight | 516.678 g/mol |
| Sample ID | 31059 |
| Solvent | CDCl3 |