| SpectraBase Compound ID | 2BrqBVULniW |
|---|---|
| InChI | InChI=1S/C30H32O13/c1-30(2,20-12-16-11-15-6-9-22(33)42-27(15)26(37)28(16)41-20)43-29-25(36)24(35)23(34)19(40-29)13-39-21(32)8-5-14-4-7-17(31)18(10-14)38-3/h4-11,19-20,23-25,29,31,34-37H,12-13H2,1-3H3/b8-5+/t19-,20?,23-,24+,25-,29+/m1/s1 |
| InChIKey | ZHYNJRGCDATHJU-BWNRXWTDSA-N |
| Mol Weight | 600.6 g/mol |
| Molecular Formula | C30H32O13 |
| Exact Mass | 600.184291 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gx39uzHW6JG |
|---|---|
| Name | 6'-O-TRANS-FERULOYLISORUTARIN |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H32O13 |
| InChI | InChI=1S/C30H32O13/c1-30(2,20-12-16-11-15-6-9-22(33)42-27(15)26(37)28(16)41-20)43-29-25(36)24(35)23(34)19(40-29)13-39-21(32)8-5-14-4-7-17(31)18(10-14)38-3/h4-11,19-20,23-25,29,31,34-37H,12-13H2,1-3H3/b8-5+/t19-,20?,23-,24+,25-,29+/m1/s1 |
| InChIKey | ZHYNJRGCDATHJU-BWNRXWTDSA-N |
| Literature Reference Author | J.REISCH,S.H.ACHENBACH |
| Literature Reference Citation | PHYTOCHEM.,31,4376(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)80484-V |
| Molecular Weight | 600.576 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWVN26833 |