Cas no 204660-15-1 (17-hydroxyandrost-1-en-3-one)
17-hydroxyandrost-1-en-3-one structure
Product Name:17-hydroxyandrost-1-en-3-one
CAS No:204660-15-1
MF:C19H28O2
MW:288.424426078796
CID:909845
PubChem ID:22846517
Update Time:2025-04-19
17-hydroxyandrost-1-en-3-one Chemical and Physical Properties
Names and Identifiers
-
- 17-hydroxyandrost-1-en-3-one
- androst-1-en-3-one, 17-hydroxy-
- SCHEMBL2545024
- (8R,9S,10R,13S,14S)-17-hydroxy-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
- 204660-15-1
-
- 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/h7,9,12,14-17,21H,3-6,8,10-11H2,1-2H3/t12?,14-,15-,16-,17?,18-,19-/m0/s1
- InChI Key： OKJCFMUGMSVJBG-OJMPBKDZSA-N
- SMILES： OC1CC[C@@H]2[C@]1(C)CC[C@@H]1[C@]3(C=CC(CC3CC[C@@H]21)=O)C
Computed Properties
- Exact Mass: 288.20904
- Monoisotopic Mass: 288.208930132g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 21
- Rotatable Bond Count: 0
- Complexity: 496
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 5
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- PSA: 37.3
17-hydroxyandrost-1-en-3-one Related Literature
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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