6b-acetyl-4a,6a-dimethyl-2,3,4,4a,4b,5,6,6a,6b,7,8,9,10,10a,11,11a,11b,12-octadecahydro-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,7,8,9,10,10a,11,11a,11b,12-octadecahydro-1H-indeno[2,1-a]phenanthren-2-yl acetate
6b-acetyl-4a,6a-dimethyl-2,3,4,4a,4b,5,6,6a,6b,7,8,9,10,10a,11,11a,11b,12-octadecahydro-1H-indeno[2,1-a]phenanthren-2-yl acetate
Compound characteristics
| Compound ID: | N017-0017 |
| Compound Name: | 6b-acetyl-4a,6a-dimethyl-2,3,4,4a,4b,5,6,6a,6b,7,8,9,10,10a,11,11a,11b,12-octadecahydro-1H-indeno[2,1-a]phenanthren-2-yl acetate |
| Molecular Weight: | 412.61 |
| Molecular Formula: | C27 H40 O3 |
| Smiles: | CC(C12CCCCC1CC1C3CC=C4CC(CCC4(C)C3CCC12C)OC(C)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2452 |
| logD: | 5.2452 |
| logSw: | -5.5168 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.571 |
| InChI Key: | HONOKMUVEQPOAM-UHFFFAOYSA-N |