Cas no 62357-03-3 (androst-5-en-17-one, 3,7-dihydroxy- (9ci))
62357-03-3 structure
Product Name:androst-5-en-17-one, 3,7-dihydroxy- (9ci)
CAS No:62357-03-3
MF:C19H28O3
MW:304.423826217651
CID:956551
PubChem ID:45092593
Update Time:2025-04-19
androst-5-en-17-one, 3,7-dihydroxy- (9ci) Chemical and Physical Properties
Names and Identifiers
-
- androst-5-en-17-one, 3,7-dihydroxy- (9ci)
- (8R,9S,10R,13S,14S)-3,7-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
- SCHEMBL9800751
- 62357-03-3
- DTXSID90667025
- Androst-5-en-17-one,3,7-dihydroxy-(9CI)
-
- Inchi： 1S/C19H28O3/c1-18-7-5-12(20)9-11(18)10-15(21)17-13-3-4-16(22)19(13,2)8-6-14(17)18/h10,12-15,17,20-21H,3-9H2,1-2H3/t12?,13-,14-,15?,17-,18-,19-/m0/s1
- InChI Key： OLPSAOWBSPXZEA-DDCKDPNUSA-N
- SMILES： OC1C=C2CC(CC[C@]2(C)[C@H]2CC[C@]3(C)C(CC[C@H]3[C@@H]21)=O)O
Computed Properties
- Exact Mass: 304.204
- Monoisotopic Mass: 304.204
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 22
- Rotatable Bond Count: 0
- Complexity: 539
- 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: 2.1
- Topological Polar Surface Area: 57.5A^2
androst-5-en-17-one, 3,7-dihydroxy- (9ci) Related Literature
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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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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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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