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About This Item
经验公式（希尔记法）:
C10H12O
CAS号:
分子量:
148.20
Beilstein:
2208779
MDL编号:
UNSPSC代码:
12352002
PubChem化学物质编号:
NACRES:
NA.22
等级
puriss.
检测方案
≥99.0% (sum of enantiomers, GC)
形式
crystals
旋光性
[α]20/D +33±1°, c = 2.5% in chloroform
光学纯度
enantiomeric ratio: 99:1 (GC)
mp
37-39 °C
SMILES字符串
O[C@H]1CCCc2ccccc12
InChI
1S/C10H12O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,10-11H,3,5,7H2/t10-/m0/s1
InChI key
JAAJQSRLGAYGKZ-JTQLQIEISA-N
基因信息
human ... UGT2B17(7367) , UGT2B7(7364)
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警示用语：
Warning
危险声明
危险分类
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
靶器官
Respiratory system
WGK
WGK 3
闪点(°F)
Not applicable
闪点(°C)
Not applicable
个人防护装备
dust mask type N95 (US), Eyeshields, Gloves
法规信息
新产品
Urmi Dhagat et al.
Bioorganic & medicinal chemistry letters, 20(17), 5274-5276 (2010-07-27)
A comparison of the structures and kinetic properties of human 20alpha-hydroxysteroid dehydrogenase (AKR1C1) and its mutant enzymes (Leu308Val and Leu308Ala) indicates that Leu308 is a selectivity determinant for substrate binding. While the Leu308Val mutation improved the catalytic efficiency (k(cat)/K(m)) of
Ingo Bichlmaier et al.
Journal of medicinal chemistry, 49(5), 1818-1827 (2006-03-03)
A set of 28 enantiomers comprising rigid and flexible secondary alcohols was synthesized by the asymmetric Corey-Bakshi-Shibata reduction. The enantiomerically pure alcohols were subjected to enzymatic glucuronidation assays employing the human UDP-glucuronosyltransferases (UGTs) 2B7 and 2B17. Both UGTs displayed high
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