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Home > Encyclopedia > (3β,12β,14β,17α)-3,8,12,14,17-Pentahydroxypregn-5-en-20-one

(3β,12β,14β,17α)-3,8,12,14,17-Pentahydroxypregn-5-en-20-one

pharmaceutical raw materials
(3β,12β,14β,17α)-3,8,12,14,17-Pentahydroxypregn-5-en-20-one structure

(3β,12β,14β,17α)-3,8,12,14,17-Pentahydroxypregn-5-en-20-one 

structure
  • CAS No:

    3513-04-0

  • Formula:

    C21H32O6

  • Chemical Name:

    (3β,12β,14β,17α)-3,8,12,14,17-Pentahydroxypregn-5-en-20-one

  • Synonyms:

    Pregn-5-en-20-one,3,8,12,14,17-pentahydroxy-,(3β,12β,14β,17α)-;14β,17α-Pregn-5-en-20-one,3β,8,12β,14,17-pentahydroxy-;(3β,12β,14β,17α)-3,8,12,14,17-Pentahydroxypregn-5-en-20-one;Deacylmetaplexigenin;Desacetylmetaplexigenin;Deacetylmetaplexigenin

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

Deacylmetaplexigenin is a pregnane glycoside isolated from Asclepias incarnate[1].

(3β,12β,14β,17α)-3,8,12,14,17-Pentahydroxypregn-5-en-20-one Basic Attributes

380.481

380.48

Characteristics

118

0.83080

1.36±0.1 g/cm3 (20 ºC 760 Torr)

218-223 °C

Computed Properties

Molecular Weight:380.5
XLogP3:-0.4
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:380.21988874
Monoisotopic Mass:380.21988874
Topological Polar Surface Area:118
Heavy Atom Count:27
Complexity:720
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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