| SpectraBase Compound ID | FP98S4hH6mI |
|---|---|
| InChI | InChI=1S/C31H48O5/c1-19-10-15-31(25(34)36-7)17-16-28(4)20(24(31)30(19,6)35)8-9-22-26(2)13-12-23(33)27(3,18-32)21(26)11-14-29(22,28)5/h8,21-24,32-33,35H,1,9-18H2,2-7H3/t21-,22-,23-,24-,26+,27-,28-,29-,30-,31+/m1/s1 |
| InChIKey | DUARVNZZZRYWJE-KZFMCFCASA-N |
| Mol Weight | 500.7 g/mol |
| Molecular Formula | C31H48O5 |
| Exact Mass | 500.350175 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 | 6ZTMPPkBNwz |
|---|---|
| Name | COUSSARIC-ACID-METHYLESTER |
| Compound Number | 1C |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H48O5 |
| InChI | InChI=1S/C31H48O5/c1-19-10-15-31(25(34)36-7)17-16-28(4)20(24(31)30(19,6)35)8-9-22-26(2)13-12-23(33)27(3,18-32)21(26)11-14-29(22,28)5/h8,21-24,32-33,35H,1,9-18H2,2-7H3/t21-,22-,23-,24-,26+,27-,28-,29-,30-,31+/m1/s1 |
| InChIKey | DUARVNZZZRYWJE-KZFMCFCASA-N |
| Literature Reference Author | B.N.SU,Y.H.KANG,R.E.PINOS,B.D.SANTARSIERO,A.D.MESECAR,D.D.SO EJARTO,H.H.S.FONG,J. |
| Literature Reference Citation | PHYTOCHEM.,64,293(2003) |
| Literature Reference DOI | 10.1016/S0031-9422(03)00268-1 |
| Molecular Weight | 500.719 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWKP4622 |