97860-15-6 (((2R)-2-amino-3-(3,5-dioxo-1,2,4-oxadiazolidin-2-yl)propanoic acid)

快速询单

结构式：

(2R)-2-amino-3-(3,5-dioxo-1,2,4-oxadiazolidin-2-yl)propanoic acidMOL文件

CAS号：

97860-15-6

英文名称：

(2R)-2-amino-3-(3,5-dioxo-1,2,4-oxadiazolidin-2-yl)propanoic acid

分子式：

C₅H₇N₃O₅

分子量：

189.126180887222

(2R)-2-amino-3-(3,5-dioxo-1,2,4-oxadiazolidin-2-yl)propanoic acid(97860-15-6)名称与标识符

名称

英文别名：

(2R)-2-amino-3-(3,5-dioxo-1,2,4-oxadiazolidin-2-yl)propanoic acid;1,2,4-Oxadiazolidine-2-propanoic acid, α-amino-3,5-dioxo-, (R)- (9CI);PD128808;EN300-26284767;NCGC00015873-01;97860-15-6;Lopac-Q-2128;

标识符

InChIKey：

ASNFTDCKZKHJSW-UWTATZPHSA-N

Inchi：

1S/C5H7N3O5/c6-2(3(9)10)1-8-4(11)7-5(12)13-8/h2H,1,6H2,(H,9,10)(H,7,11,12)/t2-/m1/s1

SMILES：

O1C(=O)NC(=O)N1C[C@@H](N)C(O)=O

(2R)-2-amino-3-(3,5-dioxo-1,2,4-oxadiazolidin-2-yl)propanoic acid(97860-15-6)物化性质

实验特性

酸度系数(pKa) : 2.12±0.10(Predicted)
密度 : 1.679±0.06 g/cm3(Predicted)

计算特性

精确分子量 : 189.03857033g/mol
氢键供体数量 : 3
氢键受体数量 : 6
可旋转化学键数量 : 3
同位素质量 : 189.03857033g/mol
重原子数量 : 13
复杂度 : 265
同位素原子数量 : 0
确定原子立构中心数量 : 1
不确定原子立构中心数量 : 0
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） : -3.9
拓扑分子极性表面积 : 122Å²

(2R)-2-amino-3-(3,5-dioxo-1,2,4-oxadiazolidin-2-yl)propanoic acid(97860-15-6)相关文献

1. A study of the nitrogen inversion barrier in quisqualic acid and its analogues
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2. Synthesis of L-quisqualic acid: a general method for enantio-efficient synthesis of β-aminoalanine derivatives
Jack E. Baldwin,Robert M. Adlington,David J. Birch J. Chem. Soc. Chem. Commun. 1985 256
3. Natural product modulators of human sensations and mood: molecular mechanisms and therapeutic potential
Tomá? Pluskal,Jing-Ke Weng Chem. Soc. Rev. 2018 47 1592
4. A convenient synthesis of the neuroexcitatory amino acid quisqalic acid and its analogues
Barrie W. Bycroft,Siri Ram Chhabra,Raymond J. Grout,Patrick J. Crowley J. Chem. Soc. Chem. Commun. 1984 1156
5. Synthesis and pharmacological characterization of the selective GluK1 radioligand (S)-2-amino-3-(6-[3H]-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl)propanoic acid ([3H]-NF608)
Anna Alcaide,Laura Marconi,Ales Marek,Isabell Haym,Birgitte Nielsen,Stine M?llerud,Mikael Jensen,Paola Conti,Darryl S. Pickering,Lennart Bunch Med. Chem. Commun. 2016 7 2136
6. A double effect molecular switch leads to a novel potent negative allosteric modulator of metabotropic glutamate receptor 5
X. Gómez-Santacana,X. Rovira,J. A. Dalton,C. Goudet,J. P. Pin,P. Gorostiza,J. Giraldo,A. Llebaria Med. Chem. Commun. 2014 5 1548
7. Asymmetric synthesis of α,β-diamino acid derivatives with an aziridine-, azetidine- and γ-lactone-skeleton via Mannich-type additions across α-chloro-N-sulfinylimines
Gert Callebaut,Sven Mangelinckx,Loránd Kiss,Reijo Sillanp??,Ferenc Fül?p,Norbert De Kimpe Org. Biomol. Chem. 2012 10 2326
8. Subject index, 1985
J. Chem. Soc. Chem. Commun. 1985 S1
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Xifu Liang,Jens Andersch,Mikael Bols J. Chem. Soc. Perkin Trans. 1 2001 2136
10. Contents pages
J. Chem. Soc. Perkin Trans. 2 1995 P077

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960化工网为您提供(2R)-2-amino-3-(3,5-dioxo-1,2,4-oxadiazolidin-2-yl)propanoic acid专业化合物百科信息，包括中文名，英文名，分子式，分子量，以及该化合物的CasNo.97860-15-6,相关理化性质;并提供了优质生产厂家信息包括厂家名称和联系方式等。 WAP版:97860-15-6 国际站:97860-15-6