| SpectraBase Compound ID | 5AsmB1Dbxlv |
|---|---|
| InChI | InChI=1S/2C22H31NO2/c2*1-13-12-23-19-16-5-3-4-14(16)6-7-17(19)21(2)22(11-9-18(24)25-21)10-8-15(13)20(22)23/h2*5,13-15,17,19-20H,3-4,6-12H2,1-2H3/t2*13-,14-,15-,17+,19+,20+,21-,22+/m11/s1 |
| InChIKey | XINMQWJWKWTBMS-KJHIBALGSA-N |
| Mol Weight | 682.99 g/mol |
| Molecular Formula | C44H62N2O4 |
| Exact Mass | 682.470958 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 | 42zccrWPzCt |
|---|---|
| Name | DEOXYCALYCIPHYLLINE-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H62N2O4 |
| InChI | InChI=1S/2C22H31NO2/c2*1-13-12-23-19-16-5-3-4-14(16)6-7-17(19)21(2)22(11-9-18(24)25-21)10-8-15(13)20(22)23/h2*5,13-15,17,19-20H,3-4,6-12H2,1-2H3/t2*13-,14-,15-,17+,19+,20+,21-,22+/m11/s1 |
| InChIKey | XINMQWJWKWTBMS-KJHIBALGSA-N |
| Literature Reference Author | X.ZHANG,J.ZHANG,Y.TAN,Q.LIU,M.LIU |
| Literature Reference Citation | MOLECULES,17,9641(2012) |
| Literature Reference DOI | 10.3390/molecules17089641 |
| Molecular Weight | 682.987 g/mol |
| Sample ID | 1413 |
| Solvent | CD3OD |