6b-acetyl-4a,6a-dimethyl-2,3,4,4a,4b,5,6,6a,6b,7,10,10a,11,11a,11b,12-hexadecahydro-1H-indeno[2,1-a]phenanthren-2-yl acetate
Chemical Structure Depiction of
6b-acetyl-4a,6a-dimethyl-2,3,4,4a,4b,5,6,6a,6b,7,10,10a,11,11a,11b,12-hexadecahydro-1H-indeno[2,1-a]phenanthren-2-yl acetate
6b-acetyl-4a,6a-dimethyl-2,3,4,4a,4b,5,6,6a,6b,7,10,10a,11,11a,11b,12-hexadecahydro-1H-indeno[2,1-a]phenanthren-2-yl acetate
Compound characteristics
| Compound ID: | 0836-0106 |
| Compound Name: | 6b-acetyl-4a,6a-dimethyl-2,3,4,4a,4b,5,6,6a,6b,7,10,10a,11,11a,11b,12-hexadecahydro-1H-indeno[2,1-a]phenanthren-2-yl acetate |
| Molecular Weight: | 410.6 |
| Molecular Formula: | C27 H38 O3 |
| Smiles: | CC(C12CC=CCC1CC1C3CC=C4CC(CCC4(C)C3CCC12C)OC(C)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2231 |
| logD: | 5.2231 |
| logSw: | -5.3735 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.571 |
| InChI Key: | XGZQDBRFMPJPBO-UHFFFAOYSA-N |