| SpectraBase Compound ID | 2q4JydCgd53 |
|---|---|
| InChI | InChI=1S/C30H48O4/c1-25(2)14-15-30(24(33)34)19(16-25)18-8-9-21-27(5)12-11-22(31)26(3,4)20(27)10-13-28(21,6)29(18,7)17-23(30)32/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/t19-,20+,21-,22+,23-,27+,28-,29-,30-/m1/s1 |
| InChIKey | YKOPWPOFWMYZJZ-RQDPUMMDSA-N |
| Mol Weight | 472.7 g/mol |
| Molecular Formula | C30H48O4 |
| Exact Mass | 472.35526 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4ecLkjWUZji |
|---|---|
| Name | ECHINOCYSTIC-ACID |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O4 |
| InChI | InChI=1S/C30H48O4/c1-25(2)14-15-30(24(33)34)19(16-25)18-8-9-21-27(5)12-11-22(31)26(3,4)20(27)10-13-28(21,6)29(18,7)17-23(30)32/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/t19-,20+,21-,22+,23-,27+,28-,29-,30-/m1/s1 |
| InChIKey | YKOPWPOFWMYZJZ-RQDPUMMDSA-N |
| Literature Reference Author | U.Y.SHAHEEN |
| Literature Reference Citation | FREE.RAD.ANTIOX.,1,23(2011) |
| Molecular Weight | 472.709 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWBT15063 |