Cas no 94991-82-9 ((3alpha,5beta)-3-hydroxy-androstane-11,17-dione)
94991-82-9 structure
Product Name:(3alpha,5beta)-3-hydroxy-androstane-11,17-dione
CAS No:94991-82-9
MF:C19H28O3
MW:304.423826217651
CID:1997704
Update Time:2025-03-10
(3alpha,5beta)-3-hydroxy-androstane-11,17-dione Chemical and Physical Properties
Names and Identifiers
-
- (3alpha,5beta)-3-hydroxy-androstane-11,17-dione
- 11-ketoetiocholanolone
- 11-ketoetioholanolone
- 11-Oxo-aetiocholanolon
- 11-Oxo-androsteron
- 11-oxo-etiocholanolone
- 3alpha-Hydroxy-11,17-dioxo-aetiocholan
- 3alpha-hydroxy-5beta-androstan-11,17-dione
- 3alpha-Hydroxy-5beta-androstandion-(11.17)
- 3alpha-hydroxy-5beta-androstanedione-(11.17)
- (3R,8S,9S,10S,13S,14S)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene-11,17-dione
-
- Inchi： 1S/C19H28O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h11-14,17,20H,3-10H2,1-2H3/t11?,12-,13+,14+,17-,18+,19+/m1/s1
- InChI Key： IUNYGQONJQTULL-OXZWHWMASA-N
- SMILES： C1[C@@]2(C)C(CC[C@]3([H])[C@]2([H])C(=O)C[C@@]2(C)[C@@]3([H])CCC2=O)C[C@H](O)C1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 22
- Rotatable Bond Count: 0
(3alpha,5beta)-3-hydroxy-androstane-11,17-dione Related Literature
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Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Tanya Ostapenko,Peter J. Collings,Samuel N. Sprunt,J. T. Gleeson Soft Matter, 2013,9, 9487-9498
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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5. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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