| SpectraBase Compound ID | HYka7QKqHLr |
|---|---|
| InChI | InChI=1S/C46H66O9/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-35-41-46(5,54-42(35)50)55-43(53-41)39-33(31-47)30-36(48)40-44(2,3)29-28-37(45(39,40)4)52-38(49)27-24-32-22-25-34(51-6)26-23-32/h14-15,22-27,30-31,35-37,39-41,43,48H,7-13,16-21,28-29H2,1-6H3/b15-14-,27-24+/t35-,36-,37+,39-,40-,41+,43?,45+,46+/m0/s1 |
| InChIKey | MCVAPTMLHAVOLH-JXVDJGDZSA-N |
| Mol Weight | 763.0 g/mol |
| Molecular Formula | C46H66O9 |
| Exact Mass | 762.470684 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FQDVcYbxokf |
|---|---|
| Name | MCVAPTMLHAVOLH-JXVDJGDZSA-N |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H66O9 |
| InChI | InChI=1S/C46H66O9/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-35-41-46(5,54-42(35)50)55-43(53-41)39-33(31-47)30-36(48)40-44(2,3)29-28-37(45(39,40)4)52-38(49)27-24-32-22-25-34(51-6)26-23-32/h14-15,22-27,30-31,35-37,39-41,43,48H,7-13,16-21,28-29H2,1-6H3/b15-14-,27-24+/t35-,36-,37+,39-,40-,41+,43?,45+,46+/m0/s1 |
| InChIKey | MCVAPTMLHAVOLH-JXVDJGDZSA-N |
| Literature Reference Author | N.ALLOUCHE,C.APEL,M.T.MARTIN,V.DUMONTET,F.GUERITTE,M.LITAUDO N |
| Literature Reference Citation | PHYTOCHEM.,70,546(2009) |
| Literature Reference DOI | 10.1016/j.phytochem.2009.01.012 |
| Molecular Weight | 763.025 g/mol |
| Sample ID | 64612 |
| Solvent | CDCl3 |