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Home > Encyclopedia > 17β-Acetyl-estradiol 3-(Tri-O-acetyl-β-D-glucuronic Acid Methyl Ester)

17β-Acetyl-estradiol 3-(Tri-O-acetyl-β-D-glucuronic Acid Methyl Ester)

17β-Acetyl-estradiol 3-(Tri-O-acetyl-β-D-glucuronic Acid Methyl Ester) structure

17β-Acetyl-estradiol 3-(Tri-O-acetyl-β-D-glucuronic Acid Methyl Ester) 

structure
  • CAS No:

    59495-70-4

  • Formula:

    C33H42O12

  • Chemical Name:

    17β-Acetyl-estradiol 3-(Tri-O-acetyl-β-D-glucuronic Acid Methyl Ester)

  • Synonyms:

    DTXSID60746932;ZINC77270125;(17alpha)-17-(Acetyloxy)estra-1,3,5(10)-trien-3-yl methyl 2,3,4-tri-O-acetyl-beta-D-glucopyranosiduronate

Description

White Solid

17β-Acetyl-estradiol 3-(Tri-O-acetyl-β-D-glucuronic Acid Methyl Ester) Basic Attributes

630.67938

630.268

DTXSID60746932

Characteristics

150

4.4

17β-Acetyl-estradiol 3-(Tri-O-acetyl-β-D-glucuronic Acid Methyl Ester) Use and Manufacturing

A protected metabolite of Estradiol (E888000).

Computed Properties

Molecular Weight:630.7
XLogP3:4.4
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:12
Exact Mass:630.26762677
Monoisotopic Mass:630.26762677
Topological Polar Surface Area:150
Heavy Atom Count:45
Complexity:1150
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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