| SpectraBase Compound ID | GFk5TXgSNtw |
|---|---|
| InChI | InChI=1S/C27H34O13/c1-12-18-19(22(31)20(12)29)15(25(34)36-3)10-38-26(18)40-27-24(33)23(32)21(30)16(39-27)11-37-17(28)9-6-13-4-7-14(35-2)8-5-13/h4-10,12,16,18-24,26-27,29-33H,11H2,1-3H3/b9-6+/t12-,16+,18-,19-,20-,21+,22+,23-,24+,26+,27-/m1/s1 |
| InChIKey | BFVPQNASGKMXJQ-PJZGDZEISA-N |
| Mol Weight | 566.6 g/mol |
| Molecular Formula | C27H34O13 |
| Exact Mass | 566.199941 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KaK4qEo6OAW |
|---|---|
| Name | ARBORTRISTOSIDE-E |
| Compound Number | XXII |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H34O13 |
| InChI | InChI=1S/C27H34O13/c1-12-18-19(22(31)20(12)29)15(25(34)36-3)10-38-26(18)40-27-24(33)23(32)21(30)16(39-27)11-37-17(28)9-6-13-4-7-14(35-2)8-5-13/h4-10,12,16,18-24,26-27,29-33H,11H2,1-3H3/b9-6+/t12-,16+,18-,19-,20-,21+,22+,23-,24+,26+,27-/m1/s1 |
| InChIKey | BFVPQNASGKMXJQ-PJZGDZEISA-N |
| Literature Reference Author | R.JAIN,M.MITTAL |
| Literature Reference Citation | AS.J.TRAD.MED.,6,188(2011) |
| Molecular Weight | 566.559 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU81143 |