| SpectraBase Compound ID | AZ60HKMaqOO |
|---|---|
| InChI | InChI=1S/C21H31NO8/c1-6-15-18(29-13(3)23)12(2)21(4,27)20(26)28-11-14-7-9-22(5)10-8-16(17(14)24)30-19(15)25/h7,12,15-16,18,27H,6,8-11H2,1-5H3/b14-7-/t12-,15?,16-,18-,21-/m1/s1 |
| InChIKey | BRHFNKAWPNHEJL-YJRXZBISSA-N |
| Mol Weight | 425.48 g/mol |
| Molecular Formula | C21H31NO8 |
| Exact Mass | 425.204967 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I0w19gbZUBv |
|---|---|
| Name | ACETYLSYNEILESINE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H31NO8 |
| InChI | InChI=1S/C21H31NO8/c1-6-15-18(29-13(3)23)12(2)21(4,27)20(26)28-11-14-7-9-22(5)10-8-16(17(14)24)30-19(15)25/h7,12,15-16,18,27H,6,8-11H2,1-5H3/b14-7-/t12-,15?,16-,18-,21-/m1/s1 |
| InChIKey | BRHFNKAWPNHEJL-YJRXZBISSA-N |
| Literature Reference Author | E.ROEDER,H.WIEDENFELD,K.LIU,R.KROEGER |
| Literature Reference Citation | PLANTA.MED.,61,97(1995) |
| Literature Reference DOI | 10.1055/s-2006-958021 |
| Molecular Weight | 425.479 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UIAP657 |