Cas no 33903-70-7 (Pregna-1,4-diene-3,11,20-trione,17-hydroxy-21-(phosphonooxy)-, disodium salt (9CI))
33903-70-7 structure
Product Name:Pregna-1,4-diene-3,11,20-trione,17-hydroxy-21-(phosphonooxy)-, disodium salt (9CI)
CAS No:33903-70-7
MF:C21H25Na2O8P
MW:482.37170958519
CID:308507
Update Time:2025-04-19
Pregna-1,4-diene-3,11,20-trione,17-hydroxy-21-(phosphonooxy)-, disodium salt (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Pregna-1,4-diene-3,11,20-trione,17-hydroxy-21-(phosphonooxy)-, disodium salt (9CI)
- disodium,[2-[(8S,9S,10R,13S,14S,17R)-17-hydroxy-10,13-dimethyl-3,11-dioxo-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] phosphate
- 251-730-3
- disodium [2-[(8S,9S,10R,13S,14S,17R)-17-hydroxy-10,13-dimethyl-3,11-dioxo-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxo-ethyl] dihydrogen phosphate
-
- Inchi： 1S/C21H27O8P.2Na/c1-19-7-5-13(22)9-12(19)3-4-14-15-6-8-21(25,17(24)11-29-30(26,27)28)20(15,2)10-16(23)18(14)19;;/h5,7,9,14-15,18,25H,3-4,6,8,10-11H2,1-2H3,(H2,26,27,28);;/q;2*+1/p-2/t14-,15-,18+,19-,20-,21-;;/m0../s1
- InChI Key： JOGWEWVSRLYXFJ-PWEPTXNASA-L
- SMILES： P(=O)([O-])([O-])OCC([C@]1(CC[C@H]2[C@@H]3CCC4=CC(C=C[C@]4(C)[C@H]3C(C[C@@]21C)=O)=O)O)=O.[Na+].[Na+]
Experimental Properties
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- PSA: 153.67000
- LogP: 2.75920
Pregna-1,4-diene-3,11,20-trione,17-hydroxy-21-(phosphonooxy)-, disodium salt (9CI) Related Literature
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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