Details of the Active Pharmaceutical Ingredient (API)

General Information of API (ID: D00997)
Name	Desonide
Synonyms	Click to Show/Hide the Synonyms of This API DESONIDE; Locapred; 638-94-8; DesOwen; Topifug; Prednacinolone; Desonate; Desonida; Desonidum; Tridesilon; Apolar; Steroderm; Sterax; D-2083; desfluorotriamcinolone acetonide; UNII-J280872D1O; 16alpha-hydroxyprednisole-16,17-acetonide; Tridesonit; Desilux; 16alpha,17alpha-isopropylidenedioxyprednisolone; CHEBI:204734; 16alpha-hydroxyprednisolone-16alpha,17-acetonide; J280872D1O; Hamiltoderm; Flusemidon; Prenacid; Reticus; Zotinar; D2083; 11beta,21-dihydroxy-16alpha,17-isopropylidenedioxypregna-1,4-diene-3,20-dione; 11beta,21-dihydroxy-16alpha,17-[(1-methylethylidene)bis(oxy)]pregna-1,4-diene-3,20-dione; 11beta,21-dihydroxy-16alpha,17alpha-isopropylidenedioxypregna-1,4-diene-3,20-dione; DSSTox_CID_26756; DSSTox_RID_81880; DSSTox_GSID_46756; D 2083; Desonidum [INN-Latin]; Desonida [INN-Spanish]; Desonide [USAN:INN:BAN]; CAS-638-94-8; Desowen (TN); Verdeso (TN); MFCD00866151; 16-alpha-Hydroxyprednisole-16,17-acetonide; NCGC00167983-01; NCGC00274065-01; EINECS 211-351-6; Desonide (USP/INN); SCHEMBL3631; 11beta,16alpha,17,21-Tetrahydroxypregna-1,4-diene-3,20-dione cyclic 16,17-acetal with acetone; GTPL7066; CHEMBL1201109; DTXSID7046756; HMS3715P20; BCP04201; HY-B0248; ZINC4212851; Tox21_112603; s1701; Tox21_112603_1; CCG-221279; DB01260; (4aR,4bS,5S,6aS,6bS,9aR,10aS,10bS)-5-hydroxy-6b-(hydroxyacetyl)-4a,6a,8,8-tetramethyl-4a,4b,5,6,6a,6b,9a,10,10a,10b,11,12-dodecahydro-2H-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-2-one; AS-13892; K016; Pregna-1,4-diene-3,20-dione, 11,21-dihydroxy-16,17-((1-methylethylidene)bis(oxy))-, (11beta,16alpha)-; D03696; AB01274712-01; AB01274712_02; 638D948; Prednisolone-16,17-acetonide, 16-alpha-hydroxy-; Q904011; Q-101382; BRD-K21528677-001-03-6; 16?,17-[1-Methylethylidenebis(oxy)]-11?,21-dihydroxypregna-1,4-diene-3,20-dione; (11ss,16alpha)-11,21-Dihydroxy-16,17-[(1-methylethylidene)bis(oxy)]-pregna-1,4-diene-3,20-dione; (1S,2S,4R,8S,9S,11S,12S,13R)-11-hydroxy-8-(2-hydroxyacetyl)-6,6,9,13-tetramethyl-5,7-dioxapentacyclo[10.8.0.0^{2,9}.0^{4,8}.0^{13,18}]icosa-14,17-dien-16-one; 16alpha,17-[1-Methylethylidenebis(oxy)]-11beta,21-dihydroxypregna-1,4-diene-3,20-dione (Desonide)
Clinical Status	Approved
PubChem CID	5311066
Formula	C24H32O6
Canonical SMILES	C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1C[C@@H]4[C@]2(OC(O4)(C)C)C(=O)CO)CCC5=CC(=O)C=C[C@]35C)O
InChI	1S/C24H32O6/c1-21(2)29-19-10-16-15-6-5-13-9-14(26)7-8-22(13,3)20(15)17(27)11-23(16,4)24(19,30-21)18(28)12-25/h7-9,15-17,19-20,25,27H,5-6,10-12H2,1-4H3/t15-,16-,17-,19+,20+,22-,23-,24+/m0/s1
InChIKey	WBGKWQHBNHJJPZ-LECWWXJVSA-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=5311066"></iframe>
Structure	3D MOL		2D MOL
Physicochemical Properties	Molecular Weight	416.5	Topological Polar Surface Area	93.1
	XlogP	2.7	Complexity	873
	Heavy Atom Count	30	Rotatable Bond Count	2
	Hydrogen Bond Donor Count	2	Hydrogen Bond Acceptor Count	6

Full List of Drug Formulations (DFMs) Containing This API
Desonide 0.05% lotion			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 Cetyl Alcohol; Edetate Disodium; Glyceryl Stearate Se; Light Mineral Oil; Methylparaben; Propylene Glycol; Propylparaben; Water; Sodium Lauryl Sulfate; Sorbitan Monostearate; Stearyl Alcohol; Anhydrous Citric Acid; Sodium Hydroxide
Dosage Form	Lotion
Company	Alembic Pharmaceuticals
DIG(s) with Biological Activity
	DIG Name	DIG Info	Representative Biological Activity of This DIG	REF
	methylparaben	DIG Info	Carbonic anhydrase VII (Ki = 780 nM)	[1]
	Kyselina citronova	DIG Info	Perilipin-1 (IC50 = 3708 nM)	[2]
	Sodium lauryl sulfate	DIG Info	Solute carrier SLCO2B1 (Ki = 1.98 uM)	[3]
	Propylparaben sodium	DIG Info	Estrogen receptor alpha (EC50 = 38200 nM)	[4]
	Cetyl alcohol	DIG Info	Breast cancer FM3A cells (EC50 = 1600 nM)	[5]
	Glyceryl monostearate	DIG Info	Prostate cancer LNCaP cells (IC50 > 100000 nM)	[6]
	Propylene glycol	DIG Info	Albendazole monooxygenase (Inhibition ratio < 20 %)	[7]
Desonide 0.05% cream			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 Aluminum Sulfate; Calcium Acetate; Cetostearyl Alcohol; Glycerin; Icodextrin; Light Mineral Oil; Methylparaben; Petrolatum; Sodium Lauryl Sulfate; Water; Yellow Wax
Dosage Form	Cream
Company	Cadila Healthcare Limited
DIG(s) with Biological Activity
	DIG Name	DIG Info	Representative Biological Activity of This DIG	REF
	methylparaben	DIG Info	Carbonic anhydrase VII (Ki = 780 nM)	[1]
	Sodium lauryl sulfate	DIG Info	Solute carrier SLCO2B1 (Ki = 1.98 uM)	[3]

References
1	Mono-/dihydroxybenzoic acid esters and phenol pyridinium derivatives as inhibitors of the mammalian carbonic anhydrase isoforms I, II, VII, IX, XII and XIV. Bioorg Med Chem. 2013 Mar 15; 21(6):1564-9.
2	PubChem BioAssay data set.
3	Bacterial metabolism rescues the inhibition of intestinal drug absorption by food and drug additives. Proc Natl Acad Sci U S A. 2020 Jul 7;117(27):16009-16018.
4	Discovery of natural estrogen receptor modulators with structure-based virtual screening. Bioorg Med Chem Lett. 2013 Jun 1; 23(11):3329-33.
5	Synthesis and notable antimalarial activity of acyclic peroxides, L-(alkyldioxy)-L-(methyldioxy)cyclododecanes. J Med Chem. 2002 Mar 14; 45(6):1374-8.
6	Lignanamides and nonalkaloidal components of Hyoscyamus niger seeds. J Nat Prod. 2002 Feb; 65(2):206-9.
7	Pharmaceutical excipients inhibit cytochrome P450 activity in cell free systems and after systemic administration. Eur J Pharm Biopharm. 2008 Sep;70(1):279-88.

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