CAS
12601-60-5 Purity
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12601-60-5 Purity
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![1-[[8-[(3-Acetyl-2,4-dihydroxy-6-methoxy-5-methylphenyl)methyl]-5,7-dihydroxy-3,4-dihydro-2,2-dimethyl-2H-1-benzopyran]-6-yl]ethanone](https://resource.alfa-chemistry.com/structure/126026-33-3.gif)
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17β-Estradiol-D3 3-β-d-glucuronide
CAS
1260231-06-8
Catalog Number
ACM1260231068
Category
Other Products
Molecular Weight
451.52
Molecular Formula
C24H29D3O8
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Specification
Synonyms
(17β)-17-Hydroxyestra-1,3,5(10)-trien-3-yl-d3 β-D-Glucopyranosiduronic Acid; 3-(β-D-Glucopyranuronosyloxy) Estra-1,3,5(10)-trien-17β-ol-d3; Estradiol-16,16,17-d3 3-Glucuronide;
IUPAC Name
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[[(8R,9S,13S,14S,17S)-16,16,17-trideuterio-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-yl]oxy]oxane-2-carboxylic acid
Canonical SMILES
CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)OC5C(C(C(C(O5)C(=O)O)O)O)O
InChI Key
MUOHJTRCBBDUOW-NCKPPFHHSA-N
Exact Mass
451.22900
H-Bond Acceptor
8
H-Bond Donor
5
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CAS
126019-27-0 Purity
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126019-27-0 Purity
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