| SpectraBase Compound ID | ESdq9pyTlsN |
|---|---|
| InChI | InChI=1S/C36H51NO12/c1-9-37-16-33(17-42-3)23(39)13-24(45-6)36-20-14-34(41)25(46-7)15-35(49-18(2)38,27(30(36)37)28(47-8)29(33)36)26(20)31(34)48-32(40)19-10-11-21(43-4)22(12-19)44-5/h10-12,20,23-31,39,41H,9,13-17H2,1-8H3/t20?,23-,24+,25+,26?,27?,28+,29?,30?,31-,33+,34+,35-,36+/m1/s1 |
| InChIKey | YVPYMQHYESYLIR-VJMCWUHMSA-N |
| Mol Weight | 689.8 g/mol |
| Molecular Formula | C36H51NO12 |
| Exact Mass | 689.341126 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | FHydzILUWbH |
|---|---|
| Name | PSEUDOACONITINE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H51NO12 |
| InChI | InChI=1S/C36H51NO12/c1-9-37-16-33(17-42-3)23(39)13-24(45-6)36-20-14-34(41)25(46-7)15-35(49-18(2)38,27(30(36)37)28(47-8)29(33)36)26(20)31(34)48-32(40)19-10-11-21(43-4)22(12-19)44-5/h10-12,20,23-31,39,41H,9,13-17H2,1-8H3/t20?,23-,24+,25+,26?,27?,28+,29?,30?,31-,33+,34+,35-,36+/m1/s1 |
| InChIKey | YVPYMQHYESYLIR-VJMCWUHMSA-N |
| Literature Reference Author | J.B.HANUMAN,A.KATZ |
| Literature Reference Citation | J.NAT.PROD.,56,801(1993) |
| Literature Reference DOI | 10.1021/np50096a001 |
| Molecular Weight | 689.800 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS4174 |