Pérez-Garrido, A.; Helguera, A. M.; López, G. C.; Cordeiro, M. N. D. S.; Escudero, A. G. A topological substructural molecular design approach for predicting mutagenesis end-points of α, β-unsaturated carbonyl compounds. Toxicology 2010, 268, 64–77.
Compound
| ID: | 222 | |
|---|---|---|
| Name: | Lasiocarpine | |
| Description: | ||
| Labels: | ||
| CAS: | 303-34-4 | |
| InChi Code: | InChI=1S/C21H33NO7/c1-7-13(2)18(23)29-16-9-11-22-10-8-15(17(16)22)12-28-19(24)21(26,14(3)27-6)20(4,5)25/h7-8,14,16-17,25-26H,9-12H2,1-6H3/b13-7-/t14-,16+,17-,21+/m1/s1 |
Properties
MCGM: Mammalian cell gene mutation test class
| Value | Source or prediction |
|---|---|
| mutagen |
experimental value |
| mutagen |
Eq5: Model for α,β-unsaturated carbonyl compounds (Training set) |