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Home > Encyclopedia > 5-PREGNEN-3-BETA,16-ALPHA,20-ALPHA-TRIOL

5-PREGNEN-3-BETA,16-ALPHA,20-ALPHA-TRIOL

5-PREGNEN-3-BETA,16-ALPHA,20-ALPHA-TRIOL structure

5-PREGNEN-3-BETA,16-ALPHA,20-ALPHA-TRIOL 

structure
  • CAS No:

    3885-13-0

  • Formula:

    C21H34O3

  • Chemical Name:

    5-PREGNEN-3-BETA,16-ALPHA,20-ALPHA-TRIOL

  • Synonyms:

    5-Pregnen-3beta,16alpha,20alpha-triol;ZINC95864953;5-Pregnen-3-beta, 16-alpha,20-alpha-triol;(3S,8S,9S,10R,13S,14S,16R,17S)-17-((S)-1-Hydroxyethyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol

5-PREGNEN-3-BETA,16-ALPHA,20-ALPHA-TRIOL Basic Attributes

334.49300

334.25100

Characteristics

60.69000

3.27790

Computed Properties

Molecular Weight:334.5
XLogP3:3.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:334.25079494
Monoisotopic Mass:334.25079494
Topological Polar Surface Area:60.7
Heavy Atom Count:24
Complexity:543
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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