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294616

Sigma-Aldrich

(+)-Pseudoephedrine hydrochloride

99%

Synonym(s):

(+)-ψ-Ephedrine hydrochloride, (1S,2S)-2-Methylamino-1-phenylpropanol hydrochloride, d-Isoephedrine hydrochloride, d-Pseudoephedrine hydrochloride

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About This Item

Linear Formula:
C6H5CH[CH(NHCH3)CH3]OH·HCl
CAS Number:
345-78-8
Molecular Weight:
201.69
Beilstein/REAXYS Number:
3915112
EC Number:
206-462-1
MDL number:
MFCD00058088
UNSPSC Code:
12352103
NACRES:
NA.22

assay

99%

optical activity

[α]25/D +61°, c = 1 in H2O

mp

185-188 °C (lit.)

SMILES string

Cl.CN[C@@H](C)[C@@H](O)c1ccccc1

InChI

1S/C10H15NO.ClH/c1-8(11-2)10(12)9-6-4-3-5-7-9;/h3-8,10-12H,1-2H3;1H/t8-,10+;/m0./s1

InChI key

BALXUFOVQVENIU-KXNXZCPBSA-N

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Biochem/physiol Actions

Non-selective adrenergic agonist; decongestant

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Certificates of Analysis (COA)

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Sean Ekins et al.
Drug metabolism and disposition: the biological fate of chemicals, 38(12), 2302-2308 (2010-09-17)
Drug-induced liver injury (DILI) is one of the most important reasons for drug development failure at both preapproval and postapproval stages. There has been increased interest in developing predictive in vivo, in vitro, and in silico models to identify compounds
Nigel Greene et al.
Chemical research in toxicology, 23(7), 1215-1222 (2010-06-18)
Drug-induced liver injury is a major issue of concern and has led to the withdrawal of a significant number of marketed drugs. An understanding of structure-activity relationships (SARs) of chemicals can make a significant contribution to the identification of potential
Zhichao Liu et al.
PLoS computational biology, 7(12), e1002310-e1002310 (2011-12-24)
Drug-induced liver injury (DILI) is a significant concern in drug development due to the poor concordance between preclinical and clinical findings of liver toxicity. We hypothesized that the DILI types (hepatotoxic side effects) seen in the clinic can be translated

Chromatograms

application for HPLC

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