| SpectraBase Compound ID | 3jjOVFbDVtM |
|---|---|
| InChI | InChI=1S/C25H38O4/c1-8-17(3)23(28)29-21-15-19(5)24(6,13-12-16(2)14-22(26)27)20-11-9-10-18(4)25(20,21)7/h8,10,14,19-21H,9,11-13,15H2,1-7H3,(H,26,27)/b16-14+,17-8-/t19-,20-,21-,24+,25+/m1/s1 |
| InChIKey | XEAOZVIWAIPENF-IWDQAQRPSA-N |
| Mol Weight | 402.6 g/mol |
| Molecular Formula | C25H38O4 |
| Exact Mass | 402.27701 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BpYFTHBauF0 |
|---|---|
| Name | 6-BETA-ANGELOYLOXYKOLAVENIC-ACID |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H38O4 |
| InChI | InChI=1S/C25H38O4/c1-8-17(3)23(28)29-21-15-19(5)24(6,13-12-16(2)14-22(26)27)20-11-9-10-18(4)25(20,21)7/h8,10,14,19-21H,9,11-13,15H2,1-7H3,(H,26,27)/b16-14+,17-8-/t19-,20-,21-,24+,25+/m1/s1 |
| InChIKey | XEAOZVIWAIPENF-IWDQAQRPSA-N |
| Literature Reference Author | T.LU,M.A.MENELAOU,D.VARGAS,F.R.FRONCZEK,N.H.FISCHER |
| Literature Reference Citation | PHYTOCHEM.,32,1483(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)85163-L |
| Molecular Weight | 402.574 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU6584 |