| SpectraBase Compound ID | 8SfpjCGaO2P |
|---|---|
| InChI | InChI=1S/C48H75NO11/c1-7-9-10-11-12-13-14-15-16-17-18-19-23-26-35(51)60-48-36-32(28-46(54,43(58-6)41(48)52)42(36)59-44(53)31-24-21-20-22-25-31)47-34(56-4)27-33(50)45(30-55-3)29-49(8-2)40(47)37(48)38(57-5)39(45)47/h20-22,24-25,32-34,36-43,50,52,54H,7-19,23,26-30H2,1-6H3/t32-,33-,34+,36-,37?,38+,39-,40?,41?,42-,43+,45+,46-,47?,48-/m1/s1 |
| InChIKey | XJYAAMGGNSBAHN-YKPXITBGSA-N |
| Mol Weight | 842.1 g/mol |
| Molecular Formula | C48H75NO11 |
| Exact Mass | 841.534012 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5y6NKGnLiY0 |
|---|---|
| Name | 14-BENZOYLACONINE-8-PALMITATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H75NO11 |
| InChI | InChI=1S/C48H75NO11/c1-7-9-10-11-12-13-14-15-16-17-18-19-23-26-35(51)60-48-36-32(28-46(54,43(58-6)41(48)52)42(36)59-44(53)31-24-21-20-22-25-31)47-34(56-4)27-33(50)45(30-55-3)29-49(8-2)40(47)37(48)38(57-5)39(45)47/h20-22,24-25,32-34,36-43,50,52,54H,7-19,23,26-30H2,1-6H3/t32-,33-,34+,36-,37?,38+,39-,40?,41?,42-,43+,45+,46-,47?,48-/m1/s1 |
| InChIKey | XJYAAMGGNSBAHN-YKPXITBGSA-N |
| Literature Reference Author | Y.BAI,H.K.DESAI,S.W.PELLETIER |
| Literature Reference Citation | J.NAT.PROD.,57,963(1994) |
| Literature Reference DOI | 10.1021/np50109a013 |
| Molecular Weight | 842.124 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS1488 |