| SpectraBase Compound ID | 8h8ry4bkJV |
|---|---|
| InChI | InChI=1S/C21H18O13/c22-6-1-10(25)15-11(26)5-12(32-14(15)2-6)7-3-9(24)13(4-8(7)23)33-21-18(29)16(27)17(28)19(34-21)20(30)31/h1-5,16-19,21-25,27-29H,(H,30,31)/t16-,17-,18+,19-,21+/m1/s1 |
| InChIKey | RWFFSMNHMCPJTQ-YRIDSSQKSA-N |
| Mol Weight | 478.36 g/mol |
| Molecular Formula | C21H18O13 |
| Exact Mass | 478.074741 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KrmLRevU5ZG |
|---|---|
| Name | ISOETIN-4'-O-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H18O13 |
| InChI | InChI=1S/C21H18O13/c22-6-1-10(25)15-11(26)5-12(32-14(15)2-6)7-3-9(24)13(4-8(7)23)33-21-18(29)16(27)17(28)19(34-21)20(30)31/h1-5,16-19,21-25,27-29H,(H,30,31)/t16-,17-,18+,19-,21+/m1/s1 |
| InChIKey | RWFFSMNHMCPJTQ-YRIDSSQKSA-N |
| Literature Reference Author | G.F.PAULI,P.JUNIOR |
| Literature Reference Citation | PHYTOCHEM.,38,1245(1995) |
| Literature Reference DOI | 10.1016/0031-9422(94)00635-7 |
| Molecular Weight | 478.366 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMS3942 |