rel-(9xi)-16-oxobeyeran-18-oic acid
Chemical Structure Depiction of
rel-(9xi)-16-oxobeyeran-18-oic acid
rel-(9xi)-16-oxobeyeran-18-oic acid
Compound characteristics
| Compound ID: | N062-0006 |
| Compound Name: | rel-(9xi)-16-oxobeyeran-18-oic acid |
| Molecular Weight: | 318.46 |
| Molecular Formula: | C20 H30 O3 |
| Smiles: | [H][C@]12CC[C@]34CC([C@@](C)(CCC4[C@]1(C)CCC[C@@]2(C)C(O)=O)C3)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.205 |
| logD: | 0.9121 |
| logSw: | -3.4285 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.214 |
| InChI Key: | KFVUFODCZDRVSS-XQSMUKOMSA-N |