| SpectraBase Compound ID | 7K9XAIyfi1s |
|---|---|
| InChI | InChI=1S/C25H24O12/c1-33-13-4-2-12(3-5-13)16-10-34-17-8-14(6-7-15(17)21(16)29)36-25-24(32)23(31)22(30)18(37-25)11-35-20(28)9-19(26)27/h2-8,10,18,22-25,30-32H,9,11H2,1H3,(H,26,27)/t18-,22-,23+,24-,25-/m1/s1 |
| InChIKey | RDTAGQKYPGLCBK-GOZZSVHWSA-N |
| Mol Weight | 516.46 g/mol |
| Molecular Formula | C25H24O12 |
| Exact Mass | 516.126776 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LLro7dzu7bM |
|---|---|
| Name | FORMONOMETIN-7-O-GLUCOPYRANOSIDE-6''-O-MALONYLESTER |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H24O12 |
| InChI | InChI=1S/C25H24O12/c1-33-13-4-2-12(3-5-13)16-10-34-17-8-14(6-7-15(17)21(16)29)36-25-24(32)23(31)22(30)18(37-25)11-35-20(28)9-19(26)27/h2-8,10,18,22-25,30-32H,9,11H2,1H3,(H,26,27)/t18-,22-,23+,24-,25-/m1/s1 |
| InChIKey | RDTAGQKYPGLCBK-GOZZSVHWSA-N |
| Literature Reference Author | H.H.PARK,T.HAKAMATSUKA,U.SANKAWA,Y.EBIZUKA |
| Literature Reference Citation | PHYTOCHEM.,38,373(1995) |
| Literature Reference DOI | 10.1016/0031-9422(94)00640-F |
| Molecular Weight | 516.458 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMS4728 |