34996-91-3 ((N-benzoyltyrosine)

快速询单

结构式：

N-benzoyltyrosineMOL文件

CAS号：

34996-91-3

英文名称：

N-benzoyltyrosine

分子式：

C₁₆H₁₅NO₄

分子量：

285.294604539871

N-benzoyltyrosine(34996-91-3)名称与标识符

名称

英文别名：

N-benzoyltyrosine;(O-benzyl)tyrosine;ACMC-209glk;Ambcb5117249;benzoyltyrosine;CBKinase1_000274;CBKinase1_012674;N-Benzoyl-DL-tyrosine;N-Benzoyl-l(-)-tyrosin;N-Benzoyl-L-tyrosin;N-benzoyl-L-tyrosine;Oprea1_079605;SureCN5793343;NSC334210;AKOS000130879;BRD-A71296838-001-01-1;CHEMBL1207014;N-benzoyl-l-tyr;CBDivE_002911;SR-01000196130;2-benzamido-3-(4-hydroxyphenyl)propanoic acid;AKOS016193982;SCHEMBL5793343;Cambridge id 5117249;NSC-334210;N-Benzoyl-4-hydroxyphenylalanine #;34996-91-3;SR-01000196130-1;KUUUDPTUEOKITK-UHFFFAOYSA-N;

标识符

InChIKey：

KUUUDPTUEOKITK-UHFFFAOYSA-N

Inchi：

1S/C16H15NO4/c18-13-8-6-11(7-9-13)10-14(16(20)21)17-15(19)12-4-2-1-3-5-12/h1-9,14,18H,10H2,(H,17,19)(H,20,21)

SMILES：

OC(C(CC1C=CC(=CC=1)O)NC(C1C=CC=CC=1)=O)=O

N-benzoyltyrosine(34996-91-3)物化性质

实验特性

PSA : 86.63
折射率 : 1.628
沸点 : 598.2°C at 760 mmHg
闪点 : 315.6°C
密度 : 1.315

计算特性

精确分子量 : 285.10015
氢键供体数量 : 3
氢键受体数量 : 4
可旋转化学键数量 : 5
同位素质量 : 285.1
重原子数量 : 21
复杂度 : 357
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 1
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : 1
拓扑分子极性表面积 : 86.6Å²

N-benzoyltyrosine(34996-91-3)推荐厂家更多厂家(1)

公司名称	手机号/电话	联系人	QQ	微信	询单
上海修时生物医药有限公司	15021598081	彭方清	571034478；3494608057		询单

N-benzoyltyrosine(34996-91-3)相关文献

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Junko Ohkanda,Ritsuko Satoh,Nobuo Kato Chem. Commun. 2009 6949
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Antun Hutinec,Athanassios Ziogas,Medhat El-Mobayed,Anton Rieker J. Chem. Soc. Perkin Trans. 1 1998 2201
9. Stereoselectivity of chemically modified α-chymotrypsin and immobilized lipases
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10. S 42. The synthesis of thyroxine and related substances. Part I. The preparation of tyrosine and some of its derivatives, and a new route to thyroxine
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