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Chemistry

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Also known as: Mls002153993, Prestwick0_000771, Prestwick1_000771, Prestwick2_000771, Prestwick3_000771, Bspbio_000842
Molecular Formula
C28H37ClO7
Molecular Weight
521.0  g/mol
InChI Key
DJHCCTTVDRAMEH-LSTGEUPGSA-N

Alclometasone Dipropionate
1 2D Structure

Alclometasone Dipropionate

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
[2-[(7R,8S,9S,10R,11S,13S,14S,16R)-7-chloro-11-hydroxy-10,13,16-trimethyl-3-oxo-17-propanoyloxy-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] propanoate
2.1.2 InChI
InChI=1S/C28H37ClO7/c1-6-22(33)35-14-21(32)28(36-23(34)7-2)15(3)10-18-24-19(29)12-16-11-17(30)8-9-26(16,4)25(24)20(31)13-27(18,28)5/h8-9,11,15,18-20,24-25,31H,6-7,10,12-14H2,1-5H3/t15-,18+,19-,20+,24-,25+,26+,27+,28?/m1/s1
2.1.3 InChI Key
DJHCCTTVDRAMEH-LSTGEUPGSA-N
2.1.4 Canonical SMILES
CCC(=O)OCC(=O)C1(C(CC2C1(CC(C3C2C(CC4=CC(=O)C=CC34C)Cl)O)C)C)OC(=O)CC
2.1.5 Isomeric SMILES
CCC(=O)OCC(=O)C1([C@@H](C[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2[C@@H](CC4=CC(=O)C=C[C@]34C)Cl)O)C)C)OC(=O)CC
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. Mls002153993

2. Prestwick0_000771

3. Prestwick1_000771

4. Prestwick2_000771

5. Prestwick3_000771

6. Bspbio_000842

7. Spbio_002781

8. Bpbio1_000928

9. Chembl1377952

10. Schembl13985345

11. Hms1570k04

12. Hms2097k04

13. Hms2230e23

14. Hms3714k04

15. Ccg-220771

16. Ncgc00179403-01

17. Smr001233327

18. Ab00513918

19. Brd-a74610643-001-03-1

2.3 Create Date
2006-06-05
3 Chemical and Physical Properties
Molecular Weight 521.0 g/mol
Molecular Formula C28H37ClO7
XLogP33.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Exact Mass520.2227812 g/mol
Monoisotopic Mass520.2227812 g/mol
Topological Polar Surface Area107 Ų
Heavy Atom Count36
Formal Charge0
Complexity1030
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count1
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 NameAlclometasone dipropionate
Drug LabelAlclometasone dipropionate ointment contains alclometasone dipropionate (7-chloro-11 ,17,21-trihydroxy-16 -methylpregna-1,4-diene-3,20-dione 17,21-dipropionate), a synthetic corticosteroid for topical dermatologic use. The corticosteroids const...
Active IngredientAlclometasone dipropionate
Dosage FormOintment; Cream
RouteTopical
Strength0.05%
Market StatusPrescription
CompanyGlenmark Generics; Fougera Pharms; Taro

2 of 2  
Drug NameAlclometasone dipropionate
Drug LabelAlclometasone dipropionate ointment contains alclometasone dipropionate (7-chloro-11 ,17,21-trihydroxy-16 -methylpregna-1,4-diene-3,20-dione 17,21-dipropionate), a synthetic corticosteroid for topical dermatologic use. The corticosteroids const...
Active IngredientAlclometasone dipropionate
Dosage FormOintment; Cream
RouteTopical
Strength0.05%
Market StatusPrescription
CompanyGlenmark Generics; Fougera Pharms; Taro

API Reference Price

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05-Mar-2021
28-May-2022
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