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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Cycloartenol synthase | ||
| Ligand | BDBM50255431 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_515551 (CHEMBL1036572) | ||
| IC50 | 1000±n/a nM | ||
| Citation |  Balliano, G; Dehmlow, H; Oliaro-Bosso, S; Scaldaferri, M; Taramino, S; Viola, F; Caron, G; Aebi, J; Ackermann, J Oxidosqualene cyclase from Saccharomyces cerevisiae, Trypanosoma cruzi, Pneumocystis carinii and Arabidopsis thaliana expressed in yeast: a model for the development of novel antiparasitic agents. Bioorg Med Chem Lett19:718-23 (2009) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Cycloartenol synthase | |||
| Name: | Cycloartenol synthase | ||
| Synonyms: | CAS1 | CAS1_ARATH | CYC | ||
| Type: | PROTEIN | ||
| Mol. Mass.: | 86025.20 | ||
| Organism: | Arabidopsis thaliana | ||
| Description: | ChEMBL_956102 | ||
| Residue: | 759 | ||
| Sequence: |
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| BDBM50255431 | |||
| n/a | |||
| Name | BDBM50255431 | ||
| Synonyms: | 4-(trifluoromethyl)phenyl 4-(5-(allyl(methyl)amino)pentyl)cyclohexyl(methyl)carbamate 2-hydroxypropane-1,2,3-tricarboxylate | CHEMBL448434 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C24H35F3N2O2 | ||
| Mol. Mass. | 440.5421 | ||
| SMILES | CN(CCCCC[C@H]1CC[C@@H](CC1)N(C)C(=O)Oc1ccc(cc1)C(F)(F)F)CC=C |r,wU:10.13,wD:7.6,(-5.96,-29.96,;-5.96,-31.5,;-4.63,-32.27,;-3.29,-31.5,;-1.96,-32.27,;-.63,-31.5,;.71,-32.27,;2.04,-31.5,;3.36,-32.27,;4.69,-31.51,;4.7,-29.97,;3.37,-29.19,;2.03,-29.96,;6.04,-29.2,;6.04,-27.66,;7.37,-29.98,;7.36,-31.52,;8.71,-29.21,;10.04,-29.99,;10,-31.53,;11.32,-32.32,;12.67,-31.58,;12.7,-30.03,;11.38,-29.24,;13.99,-32.38,;15.32,-33.15,;13.2,-33.7,;14.77,-31.05,;-7.3,-32.27,;-8.63,-31.5,;-9.96,-32.27,)| | ||
| Structure | 
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