[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] dihydrogen phosphate
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[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] dihydrogen phosphate
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CAS No:
1240-03-5
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Formula:
C18H23O5P
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Chemical Name:
[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] dihydrogen phosphate
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Synonyms:
O3-PHOSPHONOESTRONE;Estrone phosphate;UNII-52ZYE9C9X9;52ZYE9C9X9;1240-03-5;17-oxoestra-1,3,5(10)-trien-3-yl dihydrogen phosphate;3-(Phosphonooxy)estra-1,3,5(10)-trien-17-one;Estra-1,3,5(10)-trien-17-one, 3-(phosphonooxy)-;SCHEMBL5526561;CHEMBL1232577;DTXSID60924677;NCI60_001526;Q27460060;17-Oxoestra-1(10),2,4-trien-3-yl dihydrogen phosphate
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CAS No:
[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] dihydrogen phosphate Basic Attributes
350.3 g/mol
350.12831083 g/mol
52ZYE9C9X9
Computed Properties
Molecular Weight:350.3
XLogP3:1.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:350.12831083
Monoisotopic Mass:350.12831083
Topological Polar Surface Area:83.8
Heavy Atom Count:24
Complexity:572
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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