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Technical details about Prasterone, learn more about the structure, uses, toxicity, action, side effects and more

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$ API Ref.Price (USD/KG) : 268Xls
2D Structure
Also known as: 3-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one, Spectrum_000661, Specplus_000094, Spectrum2_000359, Spectrum3_000116, Spectrum4_001395
Molecular Formula
C19H28O2
Molecular Weight
288.4  g/mol
InChI Key
FMGSKLZLMKYGDP-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
3-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
2.1.2 InChI
InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3,13-16,20H,4-11H2,1-2H3
2.1.3 InChI Key
FMGSKLZLMKYGDP-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC12CCC3C(C1CCC2=O)CC=C4C3(CCC(C4)O)C
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 3-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one

2. Spectrum_000661

3. Specplus_000094

4. Spectrum2_000359

5. Spectrum3_000116

6. Spectrum4_001395

7. Spectrum5_000130

8. Kbiogr_001750

9. Kbioss_001141

10. Chembl31399

11. Divk1c_006190

12. Spbio_000457

13. Schembl9969169

14. Chebi:95212

15. Kbio1_001134

16. Kbio2_001141

17. Kbio2_003709

18. Kbio2_006277

19. Kbio3_000872

20. Dtxsid801331866

21. Albb-023670

22. Androst-5-en-17-one, 3-hydroxy-

23. Ccg-38634

24. Akos015998159

25. Smp2_000186

26. Ls-14740

27. Q27167029

2.3 Create Date
2005-03-25
3 Chemical and Physical Properties
Molecular Weight 288.4 g/mol
Molecular Formula C19H28O2
XLogP33.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass288.208930132 g/mol
Monoisotopic Mass288.208930132 g/mol
Topological Polar Surface Area37.3 Ų
Heavy Atom Count21
Formal Charge0
Complexity508
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count6
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1