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Home > Encyclopedia > [(8R,9S,13S,14S)-17-ethynyl-17-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate

[(8R,9S,13S,14S)-17-ethynyl-17-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate

[(8R,9S,13S,14S)-17-ethynyl-17-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate structure

[(8R,9S,13S,14S)-17-ethynyl-17-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate 

structure
  • CAS No:

    109945-72-4

  • Formula:

    C20H24O5S

  • Chemical Name:

    [(8R,9S,13S,14S)-17-ethynyl-17-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate

  • Synonyms:

    ethinyl estradiol sulfate;ethinylestradiol-3-sulfate;ethynylestradiol sulphate;ethynylestradiol-3-sulfate;Ethinyl estradiol sulfate;109945-72-4;(8S,9S,13S,14S)-17-Ethynyl-17-hydroxy-13-methyl-3-sulfooxy-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta(a)phenanthrene;DTXSID60911406;17-Hydroxy-19-norpregna-1(10),2,4-trien-20-yn-3-yl hydrogen sulfate

[(8R,9S,13S,14S)-17-ethynyl-17-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate Basic Attributes

376.5 g/mol

376.13444504 g/mol

Characteristics

92.2 Ų

Drug Information

ethinyl estradiol sulfate

Computed Properties

Molecular Weight:376.5
XLogP3:3.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:376.13444504
Monoisotopic Mass:376.13444504
Topological Polar Surface Area:92.2
Heavy Atom Count:26
Complexity:718
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of [(8R,9S,13S,14S)-17-ethynyl-17-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate

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