| SpectraBase Compound ID | L2fswnfkZ5P |
|---|---|
| InChI | InChI=1S/C21H25NO5.ClHO4/c1-22-8-7-13-10-17(26-3)21(27-4)20(24)18(13)15(22)9-12-5-6-16(25-2)19(23)14(12)11-22;2-1(3,4)5/h5-6,10,15H,7-9,11H2,1-4H3,(H-,23,24);(H,2,3,4,5)/t15-,22-;/m0./s1 |
| InChIKey | AHIKCQNIRRILGN-XKZCJYRQSA-N |
| Mol Weight | 471.89 g/mol |
| Molecular Formula | C21H26ClNO9 |
| Exact Mass | 471.129609 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9UsyDIU43AL |
|---|---|
| Name | STECEPHARINE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H26ClNO9 |
| InChI | InChI=1S/C21H25NO5.ClHO4/c1-22-8-7-13-10-17(26-3)21(27-4)20(24)18(13)15(22)9-12-5-6-16(25-2)19(23)14(12)11-22;2-1(3,4)5/h5-6,10,15H,7-9,11H2,1-4H3,(H-,23,24);(H,2,3,4,5)/t15-,22-;/m0./s1 |
| InChIKey | AHIKCQNIRRILGN-XKZCJYRQSA-N |
| Literature Reference Author | T.TANAHASHI,Y.SU,N.NAGAKURA,H.NAYESHIRO |
| Literature Reference Citation | CHEM.PHARM.BULL.,48,370(2000) |
| Literature Reference DOI | 10.1248/cpb.48.370 |
| Molecular Weight | 471.892 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU4973 |