| SpectraBase Compound ID | EypGnUdw1yy |
|---|---|
| InChI | InChI=1S/C30H48O5/c1-17(15-23(33)27(4,5)25(34)35)18-9-13-29(7)19(18)16-20(31)24-28(6)12-11-22(32)26(2,3)21(28)10-14-30(24,29)8/h17,20-21,23-24,31,33H,9-16H2,1-8H3,(H,34,35)/t17-,20+,21+,23?,24-,28+,29+,30+/m1/s1 |
| InChIKey | PGOJWGFAHWJYOW-NMGWJOIYSA-N |
| Mol Weight | 488.7 g/mol |
| Molecular Formula | C30H48O5 |
| Exact Mass | 488.350175 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9BWtDgioqvp |
|---|---|
| Name | ALISOL-O;3-OXO-11-BETA,23-DIHYDROXY-24,24-DIMETHYL-26,27-DINOR-PROTOST-13(17)-EN-25-OIC-ACID |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O5 |
| InChI | InChI=1S/C30H48O5/c1-17(15-23(33)27(4,5)25(34)35)18-9-13-29(7)19(18)16-20(31)24-28(6)12-11-22(32)26(2,3)21(28)10-14-30(24,29)8/h17,20-21,23-24,31,33H,9-16H2,1-8H3,(H,34,35)/t17-,20+,21+,23?,24-,28+,29+,30+/m1/s1 |
| InChIKey | PGOJWGFAHWJYOW-NMGWJOIYSA-N |
| Literature Reference Author | M.ZHAO,L.J.XU,C.T.CHE |
| Literature Reference Citation | PHYTOCHEM.,69,527(2008) |
| Literature Reference DOI | 10.1016/j.phytochem.2007.06.014 |
| Molecular Weight | 488.708 g/mol |
| Sample ID | 44777 |
| Solvent | CDCl3 |