ethyl (2E)-2-[(4aRS,6aSR)-6b-acetyl-4a,6a-dimethyl-4,4a,4b,5,6,6a,6b,7,7a,8,8a,8b-dodecahydrocyclopropa[3,4]cyclopenta[1,2-a]phenanthren-2(3H)-ylidene]hydrazine-1-carboxylate
Chemical Structure Depiction of
ethyl (2E)-2-[(4aRS,6aSR)-6b-acetyl-4a,6a-dimethyl-4,4a,4b,5,6,6a,6b,7,7a,8,8a,8b-dodecahydrocyclopropa[3,4]cyclopenta[1,2-a]phenanthren-2(3H)-ylidene]hydrazine-1-carboxylate
ethyl (2E)-2-[(4aRS,6aSR)-6b-acetyl-4a,6a-dimethyl-4,4a,4b,5,6,6a,6b,7,7a,8,8a,8b-dodecahydrocyclopropa[3,4]cyclopenta[1,2-a]phenanthren-2(3H)-ylidene]hydrazine-1-carboxylate
Compound characteristics
| Compound ID: | 8005-3761 |
| Compound Name: | ethyl (2E)-2-[(4aRS,6aSR)-6b-acetyl-4a,6a-dimethyl-4,4a,4b,5,6,6a,6b,7,7a,8,8a,8b-dodecahydrocyclopropa[3,4]cyclopenta[1,2-a]phenanthren-2(3H)-ylidene]hydrazine-1-carboxylate |
| Molecular Weight: | 410.56 |
| Molecular Formula: | C25 H34 N2 O3 |
| Smiles: | CCOC(N/N=C1\CC[C@]2(C)C3CC[C@@]4(C)C(CC5CC45C(C)=O)C3C=CC2=C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4238 |
| logD: | 4.3893 |
| logSw: | -4.7488 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.342 |
| InChI Key: | ZXUIETOUIICYPE-LUOYMPTQSA-N |