β-Estradiol 3-(β-D-glucuronide) sodium salt
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β-Estradiol 3-(β-D-glucuronide) sodium salt
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CAS No:
14982-12-8
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Formula:
C24H31NaO8
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Chemical Name:
β-Estradiol 3-(β-D-glucuronide) sodium salt
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Synonyms:
sodium,3,4,5-trihydroxy-6-[(17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl)oxy]oxane-2-carboxylic acid;
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CAS No:
Safety Information
R20/21/22
S22; S36
Xn
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, 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:471.5
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:3
Exact Mass:471.19948726
Monoisotopic Mass:471.19948726
Topological Polar Surface Area:137
Heavy Atom Count:33
Complexity:716
Undefined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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