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2D Structure
Also known as: Mls002637530, Hydrocortisoni acetas, Ncgc00183367-01, Chembl1715636, Schembl13026148, Hms2232p13
Molecular Formula
C23H32O6
Molecular Weight
404.5  g/mol
InChI Key
ALEXXDVDDISNDU-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
[2-(11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] acetate
2.1.2 InChI
InChI=1S/C23H32O6/c1-13(24)29-12-19(27)23(28)9-7-17-16-5-4-14-10-15(25)6-8-21(14,2)20(16)18(26)11-22(17,23)3/h10,16-18,20,26,28H,4-9,11-12H2,1-3H3
2.1.3 InChI Key
ALEXXDVDDISNDU-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC(=O)OCC(=O)C1(CCC2C1(CC(C3C2CCC4=CC(=O)CCC34C)O)C)O
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. Mls002637530

2. Hydrocortisoni Acetas

3. Ncgc00183367-01

4. Chembl1715636

5. Schembl13026148

6. Hms2232p13

7. Hms3373l06

8. Bbl033683

9. Stl301800

10. Akos001582713

11. Akos021734921

12. [2-(11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1h-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] Acetate

13. Ac-12502

14. Smr001317857

15. Vs-12217

16. Ft-0627126

17. Ft-0667894

18. Ah-034/06873032

19. Pregn-4-ene-3,20-dione,11beta,17alpha,21-trihydroxy-,21 Acetate

20. 2-(11,17-dihydroxy-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl Acetate

21. 2-{1,10-dihydroxy-9a,11a-dimethyl-7-oxo-1h,2h,3h,3ah,3bh,4h,5h,7h,8h,9h,9ah,9bh,10h,11h,11ah-cyclopenta[a]phenanthren-1-yl}-2-oxoethyl Acetate

2.3 Create Date
2005-03-25
3 Chemical and Physical Properties
Molecular Weight 404.5 g/mol
Molecular Formula C23H32O6
XLogP32.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass404.21988874 g/mol
Monoisotopic Mass404.21988874 g/mol
Topological Polar Surface Area101 Ų
Heavy Atom Count29
Formal Charge0
Complexity786
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count7
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Drug and Medication Information
4.1 Drug Information
1 of 2  
Drug NameHydrocortisone acetate
Drug LabelEpifoam (hydrocortisone acetate 1% and pramoxine hydrochloride 1%) is a topical aerosol foam containing: hydrocortisone acetate 1% and pramoxine hydrochloride 1% in a base containing: propylene glycol, cetyl alcohol, glyceryl monostearate and PEG 1...
Active IngredientHydrocortisone acetate
Dosage FormCream; Powder
RouteFor rx compounding; Topical
Strength100%; 2.5%
Market StatusPrescription
CompanyX Gen Pharms; Ferndale Labs

2 of 2  
Drug NameHydrocortisone acetate
Drug LabelEpifoam (hydrocortisone acetate 1% and pramoxine hydrochloride 1%) is a topical aerosol foam containing: hydrocortisone acetate 1% and pramoxine hydrochloride 1% in a base containing: propylene glycol, cetyl alcohol, glyceryl monostearate and PEG 1...
Active IngredientHydrocortisone acetate
Dosage FormCream; Powder
RouteFor rx compounding; Topical
Strength100%; 2.5%
Market StatusPrescription
CompanyX Gen Pharms; Ferndale Labs