| SpectraBase Compound ID | Cq4hpp2jMR3 |
|---|---|
| InChI | InChI=1S/C17H25ClO12/c1-16(25)10-15(30-14-9(22)8(21)7(20)6(3-19)29-14)28-4-5(13(24)27-2)17(10,26)12(23)11(16)18/h4,6-12,14-15,19-23,25-26H,3H2,1-2H3/t6-,7-,8+,9-,10+,11+,12+,14+,15-,16+,17-/m0/s1 |
| InChIKey | YMUFZYYUSKBPQJ-MSLYYUHISA-N |
| Mol Weight | 456.83 g/mol |
| Molecular Formula | C17H25ClO12 |
| Exact Mass | 456.103454 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B973XgzC4Ib |
|---|---|
| Name | PHLOYOSIDE-II |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C17H25ClO12 |
| InChI | InChI=1S/C17H25ClO12/c1-16(25)10-15(30-14-9(22)8(21)7(20)6(3-19)29-14)28-4-5(13(24)27-2)17(10,26)12(23)11(16)18/h4,6-12,14-15,19-23,25-26H,3H2,1-2H3/t6-,7-,8+,9-,10+,11+,12+,14+,15-,16+,17-/m0/s1 |
| InChIKey | YMUFZYYUSKBPQJ-MSLYYUHISA-N |
| Literature Reference Author | R.KASAI,M.KATAGIRI,K.OHTANI,K.YAMASAKI,C.R.YANG,O.TANAKA |
| Literature Reference Citation | PHYTOCHEM.,36,967(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)90473-4 |
| Molecular Weight | 456.831 g/mol |
| Solvent | D2O |
| Source File Reference | UWMS26025 |