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Home > Encyclopedia > β-D-Glucopyranosiduronic acid, (16α,17β)-3,17-dihydroxyestra-1,3,5(10)-trien-16-yl, monosodium salt

β-D-Glucopyranosiduronic acid, (16α,17β)-3,17-dihydroxyestra-1,3,5(10)-trien-16-yl, monosodium salt

β-D-Glucopyranosiduronic acid, (16α,17β)-3,17-dihydroxyestra-1,3,5(10)-trien-16-yl, monosodium salt structure

β-D-Glucopyranosiduronic acid, (16α,17β)-3,17-dihydroxyestra-1,3,5(10)-trien-16-yl, monosodium salt 

structure
  • CAS No:

    1852-44-4

  • Formula:

    C24H32O9.Na

  • Chemical Name:

    β-D-Glucopyranosiduronic acid, (16α,17β)-3,17-dihydroxyestra-1,3,5(10)-trien-16-yl, monosodium salt

  • Synonyms:

    β-D-Glucopyranosiduronic acid,(16α,17β)-3,17-dihydroxyestra-1,3,5(10)-trien-16-yl,monosodium salt;Glucopyranosiduronic acid,3,17β-dihydroxyestra-1,3,5(10)-trien-16α-yl,sodium salt,β-D-;Estrane,β-D-glucopyranosiduronic acid deriv.;Estriol 16-glucuronide sodium salt

β-D-Glucopyranosiduronic acid, (16α,17β)-3,17-dihydroxyestra-1,3,5(10)-trien-16-yl, monosodium salt Basic Attributes

488.50300

487.19440188

DTXSID50585150

Characteristics

156.91000

0.60900

-20ºC

Safety Information

R20/21/22; R40

S22; S36

Xn

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P201, P202, P261, P264, P270, P271, P280, P281, P301+P312, P302+P352, P304+P312, P304+P340, P308+P313, P312, P322, P330, P363, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:487.5
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:3
Exact Mass:487.19440188
Monoisotopic Mass:487.19440188
Topological Polar Surface Area:157
Heavy Atom Count:34
Complexity:747
Undefined Atom Stereocenter Count:11
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

Guide of β-D-Glucopyranosiduronic acid, (16α,17β)-3,17-dihydroxyestra-1,3,5(10)-trien-16-yl, monosodium salt

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