| SpectraBase Compound ID | 6BkAfMbTDID |
|---|---|
| InChI | InChI=1S/C34H47NO8/c1-7-35-17-32(18-38-3)14-13-24(40-5)34-22-15-21-23(39-4)16-33(43-19(2)36,26(30(34)35)28(41-6)29(32)34)25(22)27(21)42-31(37)20-11-9-8-10-12-20/h8-12,21-30H,7,13-18H2,1-6H3/t21?,22?,23-,24-,25?,26?,27-,28-,29?,30?,32-,33+,34-/m0/s1 |
| InChIKey | YVVFVJVAHWNXNY-ZJAAUKAZSA-N |
| Mol Weight | 597.7 g/mol |
| Molecular Formula | C34H47NO8 |
| Exact Mass | 597.330167 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5uYJ5K65Jkm |
|---|---|
| Name | CRASSICAUDINE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H47NO8 |
| InChI | InChI=1S/C34H47NO8/c1-7-35-17-32(18-38-3)14-13-24(40-5)34-22-15-21-23(39-4)16-33(43-19(2)36,26(30(34)35)28(41-6)29(32)34)25(22)27(21)42-31(37)20-11-9-8-10-12-20/h8-12,21-30H,7,13-18H2,1-6H3/t21?,22?,23-,24-,25?,26?,27-,28-,29?,30?,32-,33+,34-/m0/s1 |
| InChIKey | YVVFVJVAHWNXNY-ZJAAUKAZSA-N |
| Literature Reference Author | F.P.WANG,S.W.PELLETIER |
| Literature Reference Citation | J.NAT.PROD.,50,55(1987) |
| Literature Reference DOI | 10.1021/np50049a009 |
| Molecular Weight | 597.749 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED17491 |