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Structure

Estradiol 3-(β-D-glucuronide)(sodium salt)

CAS
14982-12-8
Catalog Number
ACM14982128
Category
Steroidal Compounds
Molecular Weight
470.49
Molecular Formula
C24H31NaO8

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Specification

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;
IUPAC Name
sodium;(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[[(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl]oxy]oxane-2-carboxylate
Canonical SMILES
CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)OC5C(C(C(C(O5)C(=O)[O-])O)O)O.[Na+]
InChI Key
DQLXNBVRGXKLKM-VGYGJRAWSA-M
Exact Mass
470.19200
Hazard Statements
Xn: Harmful;
Safety Description
22-36
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