P450 Protein:
| P450 Symbol | Cyp2e1 |
| Protein Name | Cytochrome P450 2E1 |
| Uniprot ID | P05182 |
| EC Number | 1.14.14.1 |
| Species | Rattus norvegicus |
| Txid | 10116 |
| P450 Protein Structure |
Model Confidence (pLDDT)
Very high (>90)
High (90 > 70)
Low (70 > 50)
Very low (<50)
|
| Subcellular Location | |
| Protein Sequence | GO |
Reaction Scheme:
| Chemical Conversion | C39H56ClO6P → C30H49O6P |
| Reaction Type | Oxidation |
| Chemical Bond | |
| Transformations | Cleavage of P-O, P-N and P=N Bonds |
Cyp2e1
Substrate Information:
| Substrate Name | (3beta)-3-[[(2S,4R)-4-(3-Chlorophenyl)-2-oxido-1,3,2-dioxaphosphorinan-2-yl]oxy]olean-12-en-28-oic acid |
| Substrate Chemical Formula | C39H56ClO6P |
| Substrate Smiles | C[C@]12[C@@]3(C)C([C@]4([C@@](C(O)=O)(CC3)CCC(C)(C)C4)[H])=CC[C@@]1([C@]5(C)[C@@](CC2)(C(C)(C)[C@@H](OP6(=O)O[C@H](CCO6)C7=CC(Cl)=CC=C7)CC5)[H])[H] |
| Substrate Structure |
Product Information:
| Product Name | (3beta)-3-(Phosphonooxy)olean-12-en-28-oic acid |
| Product Chemical Formula | C30H49O6P |
| Product CAS Number | 99124-02-4 |
| Product Smiles | C[C@]12[C@@]3(C)C([C@]4([C@@](C(O)=O)(CC3)CCC(C)(C)C4)[H])=CC[C@@]1([C@]5(C)[C@@](CC2)(C(C)(C)[C@@H](OP(=O)(O)O)CC5)[H])[H] |
| Product Structure |
References:
| Title: | Pharmacokinetics in Vitro and in Vivo of Two Novel Prodrugs of Oleanolic Acid in Rats and Its Hepatoprotective Effects against Liver Injury Induced by CCl4. |
| PMID: | 27018970 |
| Journal: | Molecular Pharmaceutics |
| Year: | 2016/3/28 |