| SpectraBase Compound ID | CIkAIHmIUBQ |
|---|---|
| InChI | InChI=1S/C28H38O7/c1-14(29)23-20(35-16(3)31)12-26(6)21-10-9-17-18(28(21,8)22(32)13-27(23,26)7)11-19(34-15(2)30)24(33)25(17,4)5/h9,18-21,23H,10-13H2,1-8H3/t18-,19+,20?,21+,23?,26-,27-,28+/m0/s1 |
| InChIKey | PQFJWDOZYSYFLY-FPHDUIBPSA-N |
| Mol Weight | 486.6 g/mol |
| Molecular Formula | C28H38O7 |
| Exact Mass | 486.261754 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E6KjoG0vDxv |
|---|---|
| Name | 22,27-Hexa-nor-cucurbitacin-D-2,16-diacetat |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C28H38O7 |
| InChI | InChI=1S/C28H38O7/c1-14(29)23-20(35-16(3)31)12-26(6)21-10-9-17-18(28(21,8)22(32)13-27(23,26)7)11-19(34-15(2)30)24(33)25(17,4)5/h9,18-21,23H,10-13H2,1-8H3/t18-,19+,20?,21+,23?,26-,27-,28+/m0/s1 |
| InChIKey | PQFJWDOZYSYFLY-FPHDUIBPSA-N |
| Literature Reference | Tetrahedron 39, 317 (1983). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |