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Home > Encyclopedia > Estrone β-D-Glucuronide Sodium Salt

Estrone β-D-Glucuronide Sodium Salt

Estrone β-D-Glucuronide Sodium Salt structure

Estrone β-D-Glucuronide Sodium Salt 

structure
  • CAS No:

    15087-01-1

  • Formula:

    C24H29NaO8

  • Chemical Name:

    Estrone β-D-Glucuronide Sodium Salt

  • Synonyms:

    sodium,(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]oxy]oxane-2-carboxylate;

Estrone β-D-Glucuronide Sodium Salt Basic Attributes

468.47200

468.17601216

DTXSID20635555

Characteristics

136.35000

0.04810

703.8ºC at 760 mmHg

242.9ºC

-20ºC

8.67E-21mmHg at 25°C

Safety Information

3

S22; S24/25

Computed Properties

Molecular Weight:468.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:3
Exact Mass:468.17601216
Monoisotopic Mass:468.17601216
Topological Polar Surface Area:136
Heavy Atom Count:33
Complexity:763
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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