Diethyl Stilbestrol beta-D-Glucuronide
Product Code
TRC-D445020-10MG
CAS Number
Product Format
Neat
Molecular Formula
C24 H28 O8
Molecular Weight
444.47
Product Categories
TRC, Anticancerous, Anticancerous, Pharmaceutical, Anticancerous
Product Type
MetabolitePlease login or register to add to your favourites
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Product Information
Analyte Name
Diethylstilbestrol beta-D-Glucuronide
CAS Number
2408-40-4
Molecular Formula
C24 H28 O8
Molecular Weight
444.47
Accurate Mass
444.1784
SMILES
CC\C(=C(\CC)/c1ccc(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(=O)O)cc1)\c3ccc(O)cc3
InChI
InChI=1S/C24H28O8/c1-3-17(13-5-9-15(25)10-6-13)18(4-2)14-7-11-16(12-8-14)31-24-21(28)19(26)20(27)22(32-24)23(29)30/h5-12,19-22,24-28H,3-4H2,1-2H3,(H,29,30)/b18-17+/t19-,20-,21+,22-,24+/m0/s1
IUPAC
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenoxy]oxane-2-carboxylic acid
Storage Temperature
-20°C
Shipping Temperature
Cold Room (2-8 C)
Country of Origin
CANADA
Product Type
Metabolite
Product Format
Neat
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