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levoketoconazole , Cytochrome P450 11A1 inhibitor, CAS No.142128-57-2, Cytochrome P450 11A1 inhibitor
Basic Description
Synonyms | ketoconazole|Nizoral|Levoketoconazole|Panfungol|Ketoderm|Fungarest|Fungoral|Ketoisdin|Extina|Orifungal M|Ketoconazol|Ketozole|Normocort|65277-42-1|(-)-Ketoconazole|142128-57-2|Ketoconazolum|2S,4R Ketoconazole|2S,4R-Ketoconazole|COR-003|Xolegel|(2S,4R)-ket |
Grade | Moligand™ |
Action Type | INHIBITOR |
Mechanism of action | Cytochrome P450 11A1 inhibitor |
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Names and Identifiers
IUPAC Name | 1-[4-[4-[[(2S,4R)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone |
INCHI | InChI=1S/C26H28Cl2N4O4/c1-19(33)31-10-12-32(13-11-31)21-3-5-22(6-4-21)34-15-23-16-35-26(36-23,17-30-9-8-29-18-30)24-7-2-20(27)14-25(24)28/h2-9,14,18,23H,10-13,15-17H2,1H3/t23-,26-/m1/s1 |
InChi Key | XMAYWYJOQHXEEK-ZEQKJWHPSA-N |
Canonical SMILES | CC(=O)N1CCN(CC1)c1ccc(cc1)OC[C@@H]1CO[C@@](O1)(Cn1ccnc1)c1c(cc(cc1)Cl)Cl |
Isomeric SMILES | CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC[C@@H]3CO[C@@](O3)(CN4C=CN=C4)C5=C(C=C(C=C5)Cl)Cl |
PubChem CID | 47576 |
Molecular Weight | 531.4 |
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