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Merck
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文件

294616

Sigma-Aldrich

(+)-伪麻黄碱 盐酸盐

99%

同義詞:

(+)-ψ-麻黄碱 盐酸盐, (1S,2S)-2-甲氨基-1-苯丙醇 盐酸盐, d-伪麻黄碱 盐酸盐, d-异麻黄碱 盐酸盐

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About This Item

線性公式:
C6H5CH[CH(NHCH3)CH3]OH·HCl
CAS號碼:
分子量::
201.69
Beilstein:
3915112
EC號碼:
MDL號碼:
分類程式碼代碼:
12352103
NACRES:
NA.22

化驗

99%

光學活性

[α]25/D +61°, c = 1 in H2O

mp

185-188 °C (lit.)

SMILES 字串

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 密鑰

BALXUFOVQVENIU-KXNXZCPBSA-N

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生化/生理作用

非选择性肾上腺素激动剂;减充血剂

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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

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