| SpectraBase Compound ID | 2DXfV0UM4X4 |
|---|---|
| InChI | InChI=1S/C33H40O9/c1-18-24(40-19(2)34)15-23-26(41-20(3)35)14-22-17-33(6,31(39)30(38)29(18)32(23,4)5)27(36)16-25(22)42-28(37)13-12-21-10-8-7-9-11-21/h7-14,23-27,30,36,38H,15-17H2,1-6H3/b13-12+,22-14+/t23-,24-,25-,26-,27-,30+,33-/m0/s1 |
| InChIKey | VUHNOTKLJFCHFO-IHNXBZDVSA-N |
| Mol Weight | 580.7 g/mol |
| Molecular Formula | C33H40O9 |
| Exact Mass | 580.267233 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5UkNLxBZye0 |
|---|---|
| Name | TAXUSPINANANE-H;DEAMINOACYL-CINNAMOYLTAXINE-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H40O9 |
| InChI | InChI=1S/C33H40O9/c1-18-24(40-19(2)34)15-23-26(41-20(3)35)14-22-17-33(6,31(39)30(38)29(18)32(23,4)5)27(36)16-25(22)42-28(37)13-12-21-10-8-7-9-11-21/h7-14,23-27,30,36,38H,15-17H2,1-6H3/b13-12+,22-14+/t23-,24-,25-,26-,27-,30+,33-/m0/s1 |
| InChIKey | VUHNOTKLJFCHFO-IHNXBZDVSA-N |
| Literature Reference Author | H.MORITA,A.GONDA,L.WEI,Y.YAMAMURA,H.WAKABAYASHI,K.TAKEYA,H.I TOKAWA |
| Literature Reference Citation | PHYTOCHEM.,48,857(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00870-4 |
| Molecular Weight | 580.675 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS1246 |