(3S,8R,9S,10R,13S,14S)-17-iodo-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta(a)phenanthren-3-ol

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Also known as: (3s,8r,9s,10r,13s,14s)-17-iodo-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1h-cyclopenta[a]phenanthren-3-ol, 692-056-3, 32138-69-5, 17-iodoandrosta-5,16-dien-3beta-ol, (3s,8r,9s,10r,13s,14s)-17-iodo-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15-dodecahydro-1h-cyclopenta[a]phenanthren-3-ol, (3beta)-17-iodoandrosta-5,16-dien-3-ol

Molecular Formula

C₁₉H₂₇IO

Molecular Weight

398.3 g/mol

InChI Key

DHZJEYGWSNDRGN-USOAJAOKSA-N

FDA UNII

K65A8PY7MT

1 2D Structure

(3S,8R,9S,10R,13S,14S)-17-iodo-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta(a)phenanthren-3-ol

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(3S,8R,9S,10R,13S,14S)-17-iodo-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-ol

2.1.2 InChI

InChI=1S/C19H27IO/c1-18-9-7-13(21)11-12(18)3-4-14-15-5-6-17(20)19(15,2)10-8-16(14)18/h3,6,13-16,21H,4-5,7-11H2,1-2H3/t13-,14-,15-,16-,18-,19-/m0/s1

2.1.3 InChI Key

DHZJEYGWSNDRGN-USOAJAOKSA-N

2.2 Other Identifiers

2.2.1 UNII

K65A8PY7MT

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. (3s,8r,9s,10r,13s,14s)-17-iodo-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1h-cyclopenta[a]phenanthren-3-ol

2. 692-056-3

3. 32138-69-5

4. 17-iodoandrosta-5,16-dien-3beta-ol

5. (3s,8r,9s,10r,13s,14s)-17-iodo-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15-dodecahydro-1h-cyclopenta[a]phenanthren-3-ol

6. (3beta)-17-iodoandrosta-5,16-dien-3-ol

7. (3s,8r,9s,10r,13s,14s)-2,3,4,7,8,9,10,11,12,13,14,15-dodecahydro-17-iodo-10,13-dimethyl-1h-cyclopenta[a]phenanthren-3-ol

8. K65a8py7mt

9. Schembl939291

10. C19h27io

11. Dtxsid40454083

12. Dhzjeygwsndrgn-usoajaoksa-n

13. Bcp12288

14. Cs-m1865

15. Mfcd00199204

16. Akos016004244

17. 17-iodo-androsta-5,16-dien-3beta-ol

18. Ac-25765

19. Cs-13060

20. Androsta-5,16-dien-3beta-ol, 17-iodo-

21. Db-345656

22. 3beta-hydroxy-17-iodo Androsta-5,16-diene

23. P16973

24. A875694

25. Androsta-5,16-dien-3-ol, 17-iodo-, (3beta)-

26. (3as,3br,7s,9ar,9bs,11as)-1-iodo-9a,11a-dimethyl-3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-ol

2.4 Create Date

2006-10-26

3 Chemical and Physical Properties

Molecular Formula	C₁₉H₂₇IO
Molecular Weight	398.3 g/mol
XLogP3	4.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	Da
Monoisotopic Mass	Da
Topological Polar Surface Area	20.2
Heavy Atom Count	21
Formal Charge	0
Complexity	522
Isotope Atom Count	0
Defined Atom Stereocenter Count	6
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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(3S,8R,9S,10R,13S,14S)-17-iodo-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta(a)phenanthren-3-ol manufacturers and suppliers on PharmaCompass

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