| SpectraBase Compound ID | 9qETShOQlQt |
|---|---|
| InChI | InChI=1S/C24H28O8/c1-7-12(2)22(27)30-20-18-16(10-8-15-9-11-17(26)29-19(15)18)32-24(5,6)21(20)31-23(28)13(3)14(4)25/h8-12,14,20-21,25H,3,7H2,1-2,4-6H3/t12-,14-,20-,21-/m1/s1 |
| InChIKey | CRCNWJHOCNRLKM-CZFDVXPQSA-N |
| Mol Weight | 444.48 g/mol |
| Molecular Formula | C24H28O8 |
| Exact Mass | 444.178418 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3Wg4EuB7vBi |
|---|---|
| Name | Hyuganin F |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 444.178417854 u |
| Formula | C24H28O8 |
| InChI | InChI=1S/C24H28O8/c1-7-12(2)22(27)30-20-18-16(10-8-15-9-11-17(26)29-19(15)18)32-24(5,6)21(20)31-23(28)13(3)14(4)25/h8-12,14,20-21,25H,3,7H2,1-2,4-6H3/t12-,14-,20-,21-/m1/s1 |
| InChIKey | CRCNWJHOCNRLKM-CZFDVXPQSA-N |
| Molecular Weight | 444.480 g/mol |
| SMILES | C=12[C@]([C@@](OC(C(=C)[C@](O)(C)[H])=O)(C(OC2=CC=C2C1OC(=O)C=C2)(C)C)[H])(OC(=O)[C@@](CC)(C)[H])[H] |