General Information of API (ID: D00474)
Name
Nitisinone
Synonyms    Click to Show/Hide the Synonyms of This API
Nitisinone; 104206-65-7; Orfadin; 2-(2-nitro-4-(trifluoromethyl)benzoyl)cyclohexane-1,3-dione; 2-(2-nitro-4-trifluoromethylbenzoyl)-1,3-cyclohexanedione; 2-[2-nitro-4-(trifluoromethyl)benzoyl]cyclohexane-1,3-dione; SC 0735; 2-(2-Nitro-4-trifluoromethylbenzoyl)cyclohexane-1,3-dione; Nitisinone-13C6; Nitisone; UNII-K5BN214699; 2-(Alpha,alpha,alpha-trifluoro-2-nitro-p-tuluoyl)-1,3-cyclohexanedione; MFCD01752192; SC-0735; CHEMBL1337; CHEBI:50378; 1,3-Cyclohexanedione, 2-(2-nitro-4-(trifluoromethyl)benzoyl)-; 1,3-Cyclohexanedione, 2-[2-nitro-4-(trifluoromethyl)benzoyl]-; K5BN214699; 2-{[2-nitro-4-(trifluoromethyl)phenyl]carbonyl}cyclohexane-1,3-dione; Nitisinone [USAN:INN]; nitisinona; nitisinonum; 1246815-63-3; SMR002529592; Orfadin (TN); C14H10F3NO5; Nitisinone (JAN/USAN/INN); PubChem7541; FE-0200; BIDD:PXR0129; cc-114; MLS004774025; MLS006011955; SCHEMBL338795; AMBZ0071; GTPL6834; DTXSID9042673; Nitisinone, >=95% (HPLC); SCHEMBL15996621; 2-[2-Nitro-4-(trifluoromethyl)benzoyl]-1,3-cyclohexanedione; HMS3740A15; HMS3870K03; BCP15276; HY-B0607; ABP000997; ANW-54114; BDBM50088804; NSC773149; QC-508; RB3134; AKOS015891363; AKOS015994590; ZINC100014475; ACN-035825; AM62666; CCG-222085; DB00348; EX-6233; MCULE-6109734568; MP-1670; NSC-773149; SB19017; NCGC00185778-01; NCGC00185778-02; NCGC00185778-04; NCGC00185778-07; AC-26934; AK-55736; SY047291; AB0034533; DB-014936; FT-0672739; D05177; A800922; SR-01000940576; J-505680; Q3877355; SR-01000940576-2; NTBC; Nitisone; SC0735; SC 0735; SC-0735; Z1514110653; 1,3-Cyclohexanedione,2-[2-nitro-4-(trifluoromethyl)benzoyl]-; 2-(2-Nitro-4-(trifluoromethyl)-benzoyl)cyclohexane-1,3-dione; 2-[2-nitro-4-(trifluoromethyl)phenyl]carbonylcyclohexane-1,3-dione; 2-[[2-nitro-4-(trifluoromethyl)phenyl]-oxomethyl]cyclohexane-1,3-dione
Clinical Status
Approved
Disease Indication Phenylketonuria ICD-11: 5C50 [1]
PubChem CID
115355
Formula
C14H10F3NO5
Canonical SMILES
C1CC(=O)C(C(=O)C1)C(=O)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]
InChI
1S/C14H10F3NO5/c15-14(16,17)7-4-5-8(9(6-7)18(22)23)13(21)12-10(19)2-1-3-11(12)20/h4-6,12H,1-3H2
InChIKey
OUBCNLGXQFSTLU-UHFFFAOYSA-N
   Click to Show/Hide the Molecular Data (Structure/Property) of This API
Structure
<iframe style="width: 300px; height: 300px;" frameborder="0" src="https://embed.molview.org/v1/?mode=balls&cid=115355"></iframe>
3D MOL 2D MOL
Physicochemical Properties Molecular Weight 329.23 Topological Polar Surface Area 97
XlogP 2.3 Complexity 524
Heavy Atom Count 23 Rotatable Bond Count 2
Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 8
Full List of Drug Formulations (DFMs) Containing This API
          Nitisinone 10 mg tablet Click to Show/Hide the Full List of Formulation(s):          1 Formulation(s)
             Drug Formulation 1 DFM Info click to show the detail info of this DFM
                   All DIGs    Click to Show/Hide the Full List of DIGs in This DFM
Lactose monohydrate; Glyceryl dibehenate
                   Dosage Form Oral Tablet
                   Company Cycle Pharmaceuticals
          Nitisinone 2 mg tablet Click to Show/Hide the Full List of Formulation(s):          1 Formulation(s)
             Drug Formulation 1 DFM Info click to show the detail info of this DFM
                   All DIGs    Click to Show/Hide the Full List of DIGs in This DFM
Lactose monohydrate; Glyceryl dibehenate
                   Dosage Form Oral Tablet
                   Company Cycle Pharmaceuticals
          Nitisinone 5 mg tablet Click to Show/Hide the Full List of Formulation(s):          1 Formulation(s)
             Drug Formulation 1 DFM Info click to show the detail info of this DFM
                   All DIGs    Click to Show/Hide the Full List of DIGs in This DFM
Lactose monohydrate; Glyceryl dibehenate
                   Dosage Form Oral Tablet
                   Company Cycle Pharmaceuticals
          Nitisinone 10 mg capsule Click to Show/Hide the Full List of Formulation(s):          2 Formulation(s)
             Drug Formulation 1 DFM Info click to show the detail info of this DFM
                   All DIGs    Click to Show/Hide the Full List of DIGs in This DFM
Titanium dioxide; Gelatin
                   Dosage Form Oral Capsule
                   Company Rare Disease Therapeutics
             Drug Formulation 2 DFM Info click to show the detail info of this DFM
                   All DIGs    Click to Show/Hide the Full List of DIGs in This DFM
Titanium dioxide; Gelatin; Starch, corn
                   Dosage Form Oral Capsule
                   Company Swedish Orphan Biovitrum AB
          Nitisinone 2 mg capsule Click to Show/Hide the Full List of Formulation(s):          2 Formulation(s)
             Drug Formulation 1 DFM Info click to show the detail info of this DFM
                   All DIGs    Click to Show/Hide the Full List of DIGs in This DFM
Titanium dioxide; Gelatin
                   Dosage Form Oral Capsule
                   Company Rare Disease Therapeutics
             Drug Formulation 2 DFM Info click to show the detail info of this DFM
                   All DIGs    Click to Show/Hide the Full List of DIGs in This DFM
Titanium dioxide; Gelatin; Starch, corn
                   Dosage Form Oral Capsule
                   Company Swedish Orphan Biovitrum AB
          Nitisinone 20 mg capsule Click to Show/Hide the Full List of Formulation(s):          1 Formulation(s)
             Drug Formulation 1 DFM Info click to show the detail info of this DFM
                   All DIGs    Click to Show/Hide the Full List of DIGs in This DFM
Titanium dioxide; Gelatin; Starch, corn
                   Dosage Form Oral Capsule
                   Company Swedish Orphan Biovitrum AB
          Nitisinone 5 mg capsule Click to Show/Hide the Full List of Formulation(s):          2 Formulation(s)
             Drug Formulation 1 DFM Info click to show the detail info of this DFM
                   All DIGs    Click to Show/Hide the Full List of DIGs in This DFM
Titanium dioxide; Gelatin
                   Dosage Form Oral Capsule
                   Company Rare Disease Therapeutics
             Drug Formulation 2 DFM Info click to show the detail info of this DFM
                   All DIGs    Click to Show/Hide the Full List of DIGs in This DFM
Titanium dioxide; Gelatin; Starch, corn
                   Dosage Form Oral Capsule
                   Company Swedish Orphan Biovitrum AB
References
1 FDA label for approved nitisinone from the official website of the U.S. Food and Drug Administration.

If you find any error in data or bug in web service, please kindly report it to Dr. Zhang and Dr. Mou.