rel-(13xi,14xi,17xi,19E)-3,5,14-trihydroxy-19-[2-(2-nitrobenzoyl)hydrazinylidene]-10xi-card-20(22)-enolide
Chemical Structure Depiction of
rel-(13xi,14xi,17xi,19E)-3,5,14-trihydroxy-19-[2-(2-nitrobenzoyl)hydrazinylidene]-10xi-card-20(22)-enolide
rel-(13xi,14xi,17xi,19E)-3,5,14-trihydroxy-19-[2-(2-nitrobenzoyl)hydrazinylidene]-10xi-card-20(22)-enolide
Compound characteristics
| Compound ID: | K204-0033 |
| Compound Name: | rel-(13xi,14xi,17xi,19E)-3,5,14-trihydroxy-19-[2-(2-nitrobenzoyl)hydrazinylidene]-10xi-card-20(22)-enolide |
| Molecular Weight: | 567.64 |
| Molecular Formula: | C30 H37 N3 O8 |
| Smiles: | [H][C@@]12CCC3(C)C(CCC3([C@]2([H])CCC2(C[C@@H](CCC12/C=N/NC(c1ccccc1[N+]([O-])=O)=O)O)O)O)C1COC(C=1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9581 |
| logD: | 1.7943 |
| logSw: | -3.4532 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 136.665 |
| InChI Key: | CPYGLZSHOFZGRI-HBLBNTHMSA-N |