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Structure

Estriol 17β-(β-D-glucuronide)

CAS
7219-89-8
Catalog Number
ACM7219898
Category
Steroidal Compounds
Molecular Weight
464.51
Molecular Formula
C24H32O9

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Specification

Synonyms
Estriol 17-glucuronide, MLS000069769, CID151453, LS-185894, beta-D-Glucopyranosiduronic acid, (16alpha,17beta)-3,16-dihydroxyestra-1,3,5(10)-trien-17-yl, 7219-89-8
IUPAC Name
(2S,3S,4S,5R)-6-[[(8S,9R,13S,14R,16R,17R)-3,16-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Canonical SMILES
CC12CCC3C(C1CC(C2OC4C(C(C(C(O4)C(=O)O)O)O)O)O)CCC5=C3C=CC(=C5)O
InChI Key
CZGFLAQOJPXVRV-GITAKMRZSA-N
Exact Mass
464.20500
H-Bond Acceptor
9
H-Bond Donor
6
Safety Description
22-36
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