| SpectraBase Compound ID | 7wipZVji0RR |
|---|---|
| InChI | InChI=1S/C33H42O9/c1-19-14-15-32(7,8)28(39-22(4)34)17-27(41-31(38)25-12-10-9-11-13-25)20(2)16-26-29(40-23(5)35)21(3)18-33(26,30(19)37)42-24(6)36/h9-14,16,21,26-29H,15,17-18H2,1-8H3/b19-14+,20-16+/t21-,26-,27+,28+,29-,33+/m0/s1 |
| InChIKey | JSOAFQKLCNPXBN-BIUGUXEISA-N |
| Mol Weight | 582.7 g/mol |
| Molecular Formula | C33H42O9 |
| Exact Mass | 582.282883 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G1eRQxVKwDQ |
|---|---|
| Name | PUBESCENE_A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H42O9 |
| InChI | InChI=1S/C33H42O9/c1-19-14-15-32(7,8)28(39-22(4)34)17-27(41-31(38)25-12-10-9-11-13-25)20(2)16-26-29(40-23(5)35)21(3)18-33(26,30(19)37)42-24(6)36/h9-14,16,21,26-29H,15,17-18H2,1-8H3/b19-14+,20-16+/t21-,26-,27+,28+,29-,33+/m0/s1 |
| InChIKey | JSOAFQKLCNPXBN-BIUGUXEISA-N |
| Literature Reference Author | C.VALENTE,M.J.U.FERREIRA,P.M.ABREU,M.PEDRO,F.CERQUEIRA,M.S.J .NASCIMENTO |
| Literature Reference Citation | PLANTA.MED.,69,361(2003) |
| Literature Reference DOI | 10.1055/s-2003-38875 |
| Molecular Weight | 582.691 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UIAP1933 |