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Home > Encyclopedia > (16α)-16,17-Epoxypregna-4,9(11)-diene-3,20-dione

(16α)-16,17-Epoxypregna-4,9(11)-diene-3,20-dione

(16α)-16,17-Epoxypregna-4,9(11)-diene-3,20-dione structure

(16α)-16,17-Epoxypregna-4,9(11)-diene-3,20-dione 

structure
  • CAS No:

    94088-90-1

  • Formula:

    C21H26O3

  • Chemical Name:

    (16α)-16,17-Epoxypregna-4,9(11)-diene-3,20-dione

  • Synonyms:

    Pregna-4,9(11)-diene-3,20-dione,16,17-epoxy-,(16α)-;Pregna-4,9(11)-diene-3,20-dione,16α,17-epoxy-;16,17-Epoxy-3H-cyclopenta[a]phenanthrene,pregna-4,9(11)-diene-3,20-dione deriv.;(16α)-16,17-Epoxypregna-4,9(11)-diene-3,20-dione

(16α)-16,17-Epoxypregna-4,9(11)-diene-3,20-dione Basic Attributes

326.42934

326.43

302-093-6

DTXSID50240494

Characteristics

46.7

174-179 °C

(16α)-16,17-Epoxypregna-4,9(11)-diene-3,20-dione Use and Manufacturing

Methods of Manufacturing

This product was prepared by sulfonylation and elimination of (benzenesulfonyl chloride) with 16α, 17α-epoxy-11α-hydroxy-4-pregnene-3, 20-dione (benzenesulfonyl chloride).

Uses

16α,17-Epoxypregna-4,9(11)-diene-3,20-dione is an intermediate in the synthesis of 16-Hydroxycorticosterone 20-Hydroxy-21-Acid (H918430), an oxidized derivative of corticosterone (C695700).

Computed Properties

Molecular Weight:326.4
XLogP3:2.2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:326.18819469
Monoisotopic Mass:326.18819469
Topological Polar Surface Area:46.7
Heavy Atom Count:24
Complexity:731
Defined Atom Stereocenter Count:5
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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