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Home > Product > Heterocyclic Organic Compounds > Acetyldiethylstilbestrol 2,3,4-tri-O-acetyl--D-glucuronide methyl ester

Acetyldiethylstilbestrol 2,3,4-tri-O-acetyl--D-glucuronide methyl ester | CAS Number: 40269-22-5

Catalog Number
ACM40269225
Product Name
Acetyldiethylstilbestrol 2,3,4-tri-O-acetyl--D-glucuronide methyl ester
Structure
CAS Number
40269-22-5
IUPAC Name
methyl (2S,3S,4S,5R,6S)-3,4,5-triacetyloxy-6-[4-[(E)-4-(4-acetyloxyphenyl)hex-3-en-3-yl]phenoxy]oxane-2-carboxylate
Synonyms
4-[2-[4-(Acetyloxy)phenyl]-1-ethyl-1-butenyl]phenyl-D-glucopyranosiduronic Acid Methyl Ester Triacetate
Molecular Weight
626.65
Exact Mass
626.23600
Molecular Formula
C33H38O12
Melting Point
148-150ÂșC
Purity
96%
Appearance
Pale Yellow Solid
SMILES
CCC(=C(CC)C1=CC=C(C=C1)OC(=O)C)C2=CC=C(C=C2)OC3C(C(C(C(O3)C(=O)OC)OC(=O)C)OC(=O)C)OC(=O)C
InChIKey
LMEOVEVTJJLCOK-FCQDFCJFSA-N
H-Bond Donor
0
H-Bond Acceptor
12
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