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Structure

Estradiol 17-(β-D-glucuronide)(sodium salt)

CAS
15087-02-2
Catalog Number
ACM15087022
Category
Steroidal Compounds
Molecular Weight
470.49
Molecular Formula
C24H31NaO8

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Specification

IUPAC Name
sodium;(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]oxy]oxane-2-carboxylate
Canonical SMILES
CC12CCC3C(C1CCC2OC4C(C(C(C(O4)C(=O)[O-])O)O)O)CCC5=C3C=CC(=C5)O.[Na+]
InChI Key
UQSHTUQZFYMYFO-VGYGJRAWSA-M
Exact Mass
471.19900
Hazard Statements
Xn: Harmful;
Safety Description
S22
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