尿囊素

CAS: 97-59-6 货号: A101660 分子式: C4H6N4O3 分子量: 158.12 Beilstein号: 102364 EC号: 202-592-8
有货
级别和纯度: ≥98%
别名
脲囊素 | 5-尿囊素 | 尿基间二-氮茂烷-2,4-二酮 | 5-脲基海因 | 乙醛酸二酰脲
储存条件
室温
运输条件
常规运输
★
规格
库存
价格
数量
25g
A101660-25g
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¥36.90
100g
A101660-100g
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¥49.90
500g
A101660-500g
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¥99.90
1kg
A101660-1kg
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¥169.90
5kg
A101660-5kg
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¥679.90
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为什么选择此级别

提供 ≥98% 纯度,适用于对基线干扰要求严格的色谱和分析工作流程。

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储存与运输

室温。常规运输 。请查阅批次 COA 获取详细规格。

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质量文档

SDS、COA、产品数据表及规格说明书均可下载。可通过批号查询获取批次 COA。

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文献证明

在色谱分析、有机合成和交叉偶联反应领域已被 24 篇同行评审文献引用。

概述

无臭,无味。1g溶于190ml水,500ml乙醇,能溶于热水、热醇和稀氢氧化钠溶液,微溶于水和醇,几乎不溶于乙醚。 具有两性性质,可与许多物质生成金属盐和加合物并能保持原有特性。其饱和水溶液(0.6%)呈微酸性(pH=6),在pH=4~9的水溶液中能保持稳定,在碱性溶液中和长时间煮沸时发生分解。饱和水溶液的pH为5.5。

应用

抗菌剂用曼尼希碱的合成 

抗肿瘤药舒洛芬类似物的合成

Synthesis of sulofenur analogs for use as antitumor agents.

规格

别名
脲囊素 | 5-尿囊素 | 尿基间二-氮茂烷-2,4-二酮 | 5-脲基海因 | 乙醛酸二酰脲
英文别名
UNII-344S277G0Z | 5-Ureidohydantoin | 5-ureido-Hydantoin | EINECS 202-592-8 | MFCD00005260 | BL Vital | Scar Gel | Allantoin Cream | BL Vital Skin | Scar Care | Glyoxylic(acid) diureide | CCRIS 1958 | Kenaf wet wipe | Sol Mouthwash | (2,5-dioxoimidazolidi
规格或纯度
≥98%
英文名称
Allantoin
生化机理
通过尿酸途径的嘌呤代谢物。尿酸也可与自由基反应生成尿囊素,因此尿囊素可作为氧化应激反应的有效生物标记。
应用
具有两性性质,可与许多物质生成金属盐和加合物并能保持原有特性。其饱和水溶液(0.6%)呈微酸性(pH=6),在pH=4~9的水溶液中能保持稳定,在碱性溶液中和长时间煮沸时发生分解。饱和水溶液的pH为5.5。
储存条件
室温
运输条件
常规运输
纯度
≥98%
名称和识别符
PubChem SID
EC号
202-592-8
分子类型
小分子
IUPAC Name
(2,5-dioxoimidazolidin-4-yl)urea
INCHI
1S/C4H6N4O3/c5-3(10)6-1-2(9)8-4(11)7-1/h1H,(H3,5,6,10)(H2,7,8,9,11)
InChi Key
POJWUDADGALRAB-UHFFFAOYSA-N
Smiles
C1(C(=O)NC(=O)N1)NC(=O)N
Isomeric SMILES
C1(C(=O)NC(=O)N1)NC(=O)N
分子量
158.12
Beilstein号
102364
Reaxy-Rn
83514
Reaxys-RN link address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=83514&ln=

技术文档

📋 安全数据表 (SDS)

全面的危险、操作、储存及法规合规文件。

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🔬 规格说明书

该级别的完整质量属性和验收标准。

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高级数据

系统学分类

分类树(Taxonomy Tree)

界(kingdom) 有机化合物
超类(Superclass) 有机杂环化合物
类(Class) 唑类
亚类(Subclass) 咪唑类
中间层级节点(Intermediate Tree Nodes) 暂无
直接上位类(Direct Parent) 咪唑类
其他上位类(Alternative Parents) 异脲类  炔丙基型1,3-偶极有机化合物  甲脒类  氮杂环化合物  有机光子化合物  有机氧化合物  亚胺  碳氢化合物衍生物  
分子骨架(Molecular Framework) 脂肪族杂单环化合物
取代基(Substituents) 脂肪族杂单环化合物 - 氮杂环 - 羧酰亚胺 - 羧酰亚胺酸衍生物 - 烃衍生物 - 咪唑 - 亚胺 - 异脲 - 有机1,3-双极性化合物 - 有机硝基化合物 - 有机氧化合物 - 有机氮化合物 - 有机氧化合物 - 有机氮化合物 - 丙炔型1,3-双极性有机化合物
描述(Description) 该化合物属于咪唑类有机化合物。这类化合物含有咪唑环,即具有两个氮原子位于1位和3位、三个碳原子的芳香五元环。
外部描述符(External Descriptors) a small molecule
三维结构
交互式化学结构模型





关联靶点(人)
VDR Tclin Vitamin D receptor (26531 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
A498 (42825 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
ACHN (49357 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
CAKI-1 (44928 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
CCRF-CEM (65223 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
COLO 205 (50209 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
DU-145 (51482 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
HL-60 (67320 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
HT-29 (80576 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
K562 (73714 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
KM12 (47707 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
M14 (47487 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
MCF7 (126967 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
MOLT-4 (49676 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
OVCAR-3 (48710 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
OVCAR-4 (44535 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
OVCAR-5 (45555 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
OVCAR-8 (47708 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
PC-3 (62116 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
RPMI-8226 (44974 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
RXF 393 (41971 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SF-295 (48000 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SK-MEL-2 (46422 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SK-MEL-28 (48833 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SK-MEL-5 (47095 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SK-OV-3 (52876 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SN12C (47755 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SNB-19 (46794 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
TK-10 (45540 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
U-251 (51189 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
UACC-257 (46019 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
UACC-62 (47335 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
UO-31 (46270 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
786-0 (47912 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
A549 (127892 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
NCI/ADR-RES (33767 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
T47D (39041 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
EKVX (44102 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
NCI-H322M (45589 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
HCC 2998 (41480 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
HCT-116 (91556 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
HOP-92 (41141 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Hs-578T (29457 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
NCI-H460 (60772 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SF-268 (49410 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
IGROV-1 (47897 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
LOX IMVI (44321 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
HOP-62 (47048 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
MDA-MB-435 (38290 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
MDA-N (28205 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
关联靶点(其它种属)
Hdac6 Histone deacetylase 6 (222 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Pseudomonas aeruginosa (123386 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Klebsiella pneumoniae (43867 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Staphylococcus aureus (210822 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Acinetobacter baumannii (41033 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Escherichia coli (133304 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Plasmodium falciparum (966862 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Cryptococcus neoformans (21258 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Candida albicans (78123 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
RAW264.7 (28094 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
C6 (2371 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SARS-CoV-2 (38078 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
作用机制
作用机制 Action Type target ID Target Name Target Type Target Organism Binding Site Name 参考文献
化学和物理性质
溶解性
Slightly soluble in water. Freely soluble in alkalis
密度
1.65
敏感性
对湿度敏感
熔点
238-240°C
分子量
158.120 g/mol
XLogP3
-2.200
氢键供体数Hydrogen Bond Donor Count
4
氢键受体数Hydrogen Bond Acceptor Count
3
可旋转键计数Rotatable Bond Count
1
精确质量Exact Mass
158.044 Da
单同位素质量Monoisotopic Mass
158.044 Da
拓扑极表面积Topological Polar Surface Area
113.000 Ų
重原子数Heavy Atom Count
11
形式电荷Formal Charge
0
复杂度Complexity
225.000
同位素原子数Isotope Atom Count
0
定义的原子立体中心计数Defined Atom Stereocenter Count
0
未定义的原子立体中心计数Undefined Atom Stereocenter Count
1
定义的键立体中心计数Defined Bond Stereocenter Count
0
未定义的键立体中心计数Undefined Bond Stereocenter Count
0
所有立体化学键的总数The total count of all stereochemical bonds
0
共价键合单元计数Covalently-Bonded Unit Count
1
安全和危险性(GHS)
象形图
信号词
警告
危险声明

H302: 吞食有害

预防措施声明

P264: 处理后要彻底洗手。

P270: 使用本产品时,请勿进食、饮水或吸烟。

P330: 漱口

P301+P312: 如误吞咽:如感觉不适,呼叫急救中心/医生。

P501: 将内容物/容器处理到。。。

WGK Germany
1
RTECS
YT1600000
Merck Index
258
个人防护装备
dust mask type N95 (US),Eyeshields,Gloves
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批号(Lot Number) 证书类型 货号
H2619111 分析证书 A101660
H2619110 分析证书 A101660
H2619109 分析证书 A101660
H2619108 分析证书 A101660
J2209034 分析证书 A101660
D2602168 分析证书 A101660
D2602169 分析证书 A101660
D2602170 分析证书 A101660
D2602171 分析证书 A101660
D2602196 分析证书 A101660
E2423141 分析证书 A101660
K2307083 分析证书 A101660
I2509219 分析证书 A101660
I2509235 分析证书 A101660
H2511213 分析证书 A101660
H2511212 分析证书 A101660
H2511211 分析证书 A101660
E2325062 分析证书 A101660
K2408183 分析证书 A101660
K2408184 分析证书 A101660
K2408185 分析证书 A101660
J2209056 分析证书 A101660
E2423432 分析证书 A101660
E2423140 分析证书 A101660
E2423139 分析证书 A101660
C2429003 分析证书 A101660
C2429002 分析证书 A101660
K2307027 分析证书 A101660
K2307084 分析证书 A101660
L2327032 分析证书 A101660
I2113164 分析证书 A101660
I2111098 分析证书 A101660
I2111108 分析证书 A101660
I2111084 分析证书 A101660
H2109022 分析证书 A101660
L2003096 分析证书 A101660
L2003095 分析证书 A101660
J2209033 分析证书 A101660
J2209040 分析证书 A101660
D2326037 分析证书 A101660
E2310658 分析证书 A101660
E2310652 分析证书 A101660

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此产品的引用文献
引用文献
1. Qiuzheng Du, Wenjun Guo, Yingying Shi, Ziwei Jing, Zhi Sun.  (2023)  Boric acid-functionalized lanthanide metal-organic framework used as a ratiometric fluorescence probe for uric acid detection.  MICROCHEMICAL JOURNAL,  [10.1016/j.microc.2023.109161]
2. Fanxing Xu, Jingxian Wu, Yumei Hu, Chun Chu, Wenjun Liu, Xiang Li, Wen Zheng, Weishuo Yang, Boyan Zhao, Jiangxue Guo, Zhenzhong Wang, Ying Jia, Wei Xiao.  (2023)  Mechanisms of action underlying the effect of Tongsaimai on wound healing based on experimental and network pharmacology.  JOURNAL OF ETHNOPHARMACOLOGY,  [PMID:37031824] [10.1016/j.jep.2023.116451]
3. Xu Zhang, Xiaotong Wang, Rui Shi, Xiaoku Ran, Xiahong He, Deqiang Dou.  (2023)  Effective substances and mechanism of red ginseng on rats with spleen-deficiency syndrome based on the substance and energy metabolism as well as the “brain-gut” axis.  JOURNAL OF ETHNOPHARMACOLOGY,  [PMID:37003398] [10.1016/j.jep.2023.116438]
4. Gang Wang, Jiali Li, Jing Ji, Lishuang Zhang, Bowen Li, Jiaqi Zhang, Xinya Wang, Wenju Song, Chunfeng Guan.  (2023)  Combined application of allantoin and strain JIT1 synergistically or additively promotes the growth of rice under 2, 4-DCP stress by enhancing the phosphate solubility, improving soil enzyme activities and photosynthesis.  JOURNAL OF PLANT PHYSIOLOGY,  [PMID:36739690] [10.1016/j.jplph.2023.153941]
5. Qiqin Wang, Lingjue Sun, Huihui Wu, Ning Deng, Xianglong Zhao, Jingwei Zhou, Tingting Zhang, Hai Han, Zhengjin Jiang.  (2022)  Rapid fabrication of zwitterionic sulfobetaine vinylimidazole-based monoliths via photoinitiated copolymerization for hydrophilic interaction chromatography.  Journal of Pharmaceutical Analysis,  [PMID:36320596] [10.1016/j.jpha.2022.05.008]
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本产品的纯度是多少?
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本产品的 CAS 号、分子式和分子量是多少?
本产品的 CAS 号为 97-59-6,分子式为 C4H6N4O3,分子量为 158.12 g/mol。InChIKey POJWUDADGALRAB-UHFFFAOYSA-N。
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