| SpectraBase Compound ID | CESoM84dZSd |
|---|---|
| InChI | InChI=1S/C27H41NO9/c1-7-28(31)12-23(3)9-8-17(33-5)26-20(23)21(37-14(2)29)27(22(26)28)25(35-13-36-27)11-16(32-4)15-10-24(26,30)19(25)18(15)34-6/h15-22,30H,7-13H2,1-6H3/t15-,16+,17+,18+,19+,20-,21+,22?,23+,24+,25-,26-,27+,28?/m1/s1 |
| InChIKey | YWSXJRORNOTIDP-XTMIKVJSSA-N |
| Mol Weight | 523.6 g/mol |
| Molecular Formula | C27H41NO9 |
| Exact Mass | 523.278132 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CykizQxYVfX |
|---|---|
| Name | DETALINE-N-OXIDE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H41NO9 |
| InChI | InChI=1S/C27H41NO9/c1-7-28(31)12-23(3)9-8-17(33-5)26-20(23)21(37-14(2)29)27(22(26)28)25(35-13-36-27)11-16(32-4)15-10-24(26,30)19(25)18(15)34-6/h15-22,30H,7-13H2,1-6H3/t15-,16+,17+,18+,19+,20-,21+,22?,23+,24+,25-,26-,27+,28?/m1/s1 |
| InChIKey | YWSXJRORNOTIDP-XTMIKVJSSA-N |
| Literature Reference Author | Y.BAI,H.K.DESAI,S.W.PELLETIER |
| Literature Reference Citation | J.NAT.PROD.,58,929(1995) |
| Literature Reference DOI | 10.1021/np50120a018 |
| Molecular Weight | 523.624 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVP6490 |