Cas no 54498-90-7 (Androsta-1,4-diene-3,11-dione)
Androsta-1,4-diene-3,11-dione structure
Product Name:Androsta-1,4-diene-3,11-dione
CAS No:54498-90-7
MF:C19H24O2
MW:284.392665863037
CID:2670297
Update Time:2023-08-06
Androsta-1,4-diene-3,11-dione Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Androstadiene-3,11-dione
- HNDUFCYJJVPVMF-AEIBSFOJSA-N
- Androsta-1,4-diene-3,11-dione
-
- Inchi： 1S/C19H24O2/c1-18-8-3-4-15(18)14-6-5-12-10-13(20)7-9-19(12,2)17(14)16(21)11-18/h7,9-10,14-15,17H,3-6,8,11H2,1-2H3/t14-,15-,17+,18-,19-/m0/s1
- InChI Key： HNDUFCYJJVPVMF-AEIBSFOJSA-N
- SMILES： O=C1C[C@]2(C)CCC[C@H]2[C@@H]2CCC3=CC(C=C[C@]3(C)[C@H]21)=O
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 21
- Rotatable Bond Count: 0
- Complexity: 584
- Topological Polar Surface Area: 34.1
Androsta-1,4-diene-3,11-dione Related Literature
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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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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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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