rel-(10xi,13xi,14xi)-3,14-dihydroxycard-20(22)-enolide
Chemical Structure Depiction of
rel-(10xi,13xi,14xi)-3,14-dihydroxycard-20(22)-enolide
rel-(10xi,13xi,14xi)-3,14-dihydroxycard-20(22)-enolide
Compound characteristics
| Compound ID: | 0449-0104 |
| Compound Name: | rel-(10xi,13xi,14xi)-3,14-dihydroxycard-20(22)-enolide |
| Molecular Weight: | 374.52 |
| Molecular Formula: | C23 H34 O4 |
| Smiles: | [H]C12CC[C@@]3([H])C4(CC[C@@H](C5COC(C=5)=O)C4(C)CC[C@]3([H])C2(C)CCC(C1)O)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6216 |
| logD: | 2.6216 |
| logSw: | -3.9369 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.25 |
| InChI Key: | XZTUSOXSLKTKJQ-KXFCQUMHSA-N |