cholest-5-en-3-yl [(8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate
Chemical Structure Depiction of
cholest-5-en-3-yl [(8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate
cholest-5-en-3-yl [(8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate
Compound characteristics
| Compound ID: | Y040-7345 |
| Compound Name: | cholest-5-en-3-yl [(8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate |
| Molecular Weight: | 663.34 |
| Molecular Formula: | C41 H55 Cl O5 |
| Smiles: | [H][C@@]12CC=C3C[C@H](CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@]12[H])[C@H](C)CCCC(C)C)OC(COc1cc2c(cc1[Cl])C1CCCC=1C(=O)O2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 9.8074 |
| logD: | 9.8074 |
| logSw: | -6.6991 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.649 |
| InChI Key: | RZYNMTLVYNLKHU-CVZVXNOZSA-N |