Cas no 54549-89-2 (Androst-5-en-7-one, 3-(acetyloxy)-4,4-dimethyl-, (3beta)-)
54549-89-2 structure
Product Name:Androst-5-en-7-one, 3-(acetyloxy)-4,4-dimethyl-, (3beta)-
CAS No:54549-89-2
MF:C23H34O3
MW:358.514267444611
CID:2670347
Update Time:2023-08-06
Androst-5-en-7-one, 3-(acetyloxy)-4,4-dimethyl-, (3beta)- Chemical and Physical Properties
Names and Identifiers
-
- 3β-Acetyloxy-4,4-dimethylandrost-5-en-7-one
- RVZFRFPJFJRTJV-OXWFJDQKSA-N
- Androst-5-en-7-one, 3-(acetyloxy)-4,4-dimethyl-, (3.beta.)-
- 3beta-Acetyloxy-4,4-dimethylandrost-5-en-7-one
- 4,4-Dimethyl-7-oxoandrost-5-en-3-yl acetate #
- Androst-5-en-7-one, 3-(acetyloxy)-4,4-dimethyl-, (3beta)-
-
- Inchi： 1S/C23H34O3/c1-14(24)26-19-9-12-23(5)16-8-11-22(4)10-6-7-15(22)20(16)17(25)13-18(23)21(19,2)3/h13,15-16,19-20H,6-12H2,1-5H3/t15-,16-,19-,20-,22-,23+/m0/s1
- InChI Key： RVZFRFPJFJRTJV-OXWFJDQKSA-N
- SMILES： O(C(C)=O)[C@H]1CC[C@@]2(C)C(=CC([C@@H]3[C@@H]2CC[C@]2(C)CCC[C@H]23)=O)C1(C)C
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 26
- Rotatable Bond Count: 2
- Complexity: 675
- Topological Polar Surface Area: 43.4
Androst-5-en-7-one, 3-(acetyloxy)-4,4-dimethyl-, (3beta)- Related Literature
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Robert P. Davies,Maria A. Giménez,Laura Patel,Andrew J. P. White Dalton Trans., 2008, 5705-5707
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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