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(16β)-Estra-1,3,5(10)-triene-3,16-diol

(16β)-Estra-1,3,5(10)-triene-3,16-diol structure

CAS No:
1225-58-7
Formula:
C18H24O2
Chemical Name:
(16β)-Estra-1,3,5(10)-triene-3,16-diol
Synonyms:
Estra-1,3,5(10)-triene-3,16-diol,(16β)-;Estra-1,3,5(10)-triene-3,16β-diol;(16β)-Estra-1,3,5(10)-triene-3,16-diol;16β-Estradiol;3,16β-Dihydroxyestra-1,3,5(10)-triene;NSC 46476

Description

Estra-1,3,5(10)-triene-3,16beta-diol is a 3-hydroxy steroid that is estra-1,3,5(10)-triene substituted by hydroxy groups at positions 3 and 16. It is a 3-hydroxy steroid and a 16beta-hydroxy steroid. It derives from a hydride of an estrane.

(16β)-Estra-1,3,5(10)-triene-3,16-diol Basic Attributes

Molecular Weight：

272.38200

Exact Mass：

272.38

UNII：

06J092O3KB

NSC Number：

46476

Characteristics

PSA：

40.46000

XLogP3：

3.60920

Density：

1.17g/cm3

Melting Point：

226.5-227 °C

Boiling Point：

445.9ºC at 760 mmHg

Flash Point：

209.6ºC

Refractive Index：

1.599

Drug Information

MeSH Entry Terms：

16alpha-estradiol

Computed Properties

Molecular Weight:272.4
XLogP3:3.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Exact Mass:272.177630004
Monoisotopic Mass:272.177630004
Topological Polar Surface Area:40.5
Heavy Atom Count:20
Complexity:382
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (16β)-Estra-1,3,5(10)-triene-3,16-diol

Description
Basic Attributes
Characteristics
Drug Information
Computed Properties

(16β)-Estra-1,3,5(10)-triene-3,16-diol

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