| SpectraBase Compound ID | A2aRavNud0t |
|---|---|
| InChI | InChI=1S/C34H42O9/c1-21(41-22(2)35)34(40)18-16-29(38)33(34,5)30(43-31(39)14-11-24-9-7-6-8-10-24)20-27-28(37)13-12-25-19-26(42-23(3)36)15-17-32(25,27)4/h6-12,14,21,26-27,30,40H,13,15-20H2,1-5H3/b14-11+/t21?,26?,27?,30?,32?,33?,34-/m0/s1 |
| InChIKey | YIRASKMCKWBQOH-GRJTYBFKSA-N |
| Mol Weight | 594.7 g/mol |
| Molecular Formula | C34H42O9 |
| Exact Mass | 594.282883 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1OKZmhxDUq9 |
|---|---|
| Name | ACETYLGRACIGENIN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H42O9 |
| InChI | InChI=1S/C34H42O9/c1-21(41-22(2)35)34(40)18-16-29(38)33(34,5)30(43-31(39)14-11-24-9-7-6-8-10-24)20-27-28(37)13-12-25-19-26(42-23(3)36)15-17-32(25,27)4/h6-12,14,21,26-27,30,40H,13,15-20H2,1-5H3/b14-11+/t21?,26?,27?,30?,32?,33?,34-/m0/s1 |
| InChIKey | YIRASKMCKWBQOH-GRJTYBFKSA-N |
| Literature Reference Author | Q.-Z.MU,Y.-M.SHEN,Q.-L.ZHOU,S.-Q.WANG,B.WU,Q.-T.ZHENG |
| Literature Reference Citation | PLANTA.MED.,58,200(1992) |
| Literature Reference DOI | 10.1055/s-2006-961429 |
| Molecular Weight | 594.702 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UIAP303 |