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节球毒素

更新时间:2024-01-03 15:40:17

节球毒素结构式
节球毒素结构式
品牌特惠专场
常用名 节球毒素 英文名 Nodularin
CAS号 118399-22-7 分子量 824.963
密度 1.3±0.1 g/cm3 沸点 N/A
分子式 C41H60N8O10 熔点 N/A
MSDS 中文版 美版 闪点 11℃
符号 GHS02 GHS06 GHS08
GHS02, GHS06, GHS08
信号词 Danger

 节球毒素名称

中文名 节球毒素
英文名 (2Z,5R,6S,9S,12S,13S,16R)-9-[3-(diaminomethylideneamino)propyl]-2-ethylidene-12-[(1E,3E,5S,6S)-6-methoxy-3,5-dimethyl-7-phenylhepta-1,3-dienyl]-1,6,13-trimethyl-3,7,10,14,19-pentaoxo-1,4,8,11,15-pentazacyclononadecane-5,16-dicarboxylic acid
英文别名 更多

 节球毒素物理化学性质

密度 1.3±0.1 g/cm3
分子式 C41H60N8O10
分子量 824.963
闪点 11℃
精确质量 824.443237
PSA 282.44000
LogP -0.56
折射率 1.598
储存条件 −20°C
水溶解性 methanol: 2 mg/mL Further dilute to 10% (v/v) methanol. Store solutions at −20°C for up to six months.
更多

1. 性状:无可用

2. 密度(g/mL,25/4℃):无可用

3. 相对蒸汽密度(g/mL,空气=1):无可用

计算化学数据 纠错 | 编辑

1.疏水参数计算参考值(XlogP):1.7

2.氢键供体数量:8

3.氢键受体数量:11

4.可旋转化学键数量:13

5.互变异构体数量:216

6.拓扑分子极性表面积285

7.重原子数量:59

8.表面电荷:0

9.复杂度:1620

10.同位素原子数量:0

11.确定原子立构中心数量:8

12.不确定原子立构中心数量:0

13.确定化学键立构中心数量:3

14.不确定化学键立构中心数量:0

15.共价键单元数量:1

 节球毒素MSDS

 节球毒素安全信息

符号 GHS02 GHS06 GHS08
GHS02, GHS06, GHS08
信号词 Danger
危害声明 H225-H301 + H311 + H331-H370
警示性声明 P210-P260-P280-P301 + P310-P311
个人防护装备 Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US)
危害码 (欧洲) T: Toxic;
风险声明 (欧洲) 23/24/25-38
安全声明 (欧洲) 36/37-45
危险品运输编码 UN 2811 6.1/PG 2
WGK德国 3
RTECS号 GU2294250

 节球毒素合成线路

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节球毒素结构式

节球毒素

118399-22-7

文献:Journal of Medicinal Chemistry, , vol. 52, # 18 p. 5759 - 5762

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节球毒素结构式

节球毒素

118399-22-7

文献:Journal of Medicinal Chemistry, , vol. 52, # 18 p. 5759 - 5762

 节球毒素上下游产品

节球毒素上游产品  2

节球毒素下游产品  0

 节球毒素文献26

更多文献
Biological treatment options for cyanobacteria metabolite removal--a review.

Water Res. 46(5) , 1536-48, (2012)

The treatment of cyanobacterial metabolites can consume many resources for water authorities which can be problematic especially with the recent shift away from chemical- and energy-intensive processe...

Simultaneous detection of nine cyanotoxins in drinking water using dual solid-phase extraction and liquid chromatography-mass spectrometry.

Toxicon 58(2) , 209-18, (2011)

A solid-phase extraction (SPE)-liquid chromatography (LC)-mass spectrometry (MS) method was developed to concentrate and detect nine cyanotoxins simultaneously, including six microcystins (MCs) congen...

Tumor promoters--microcystin-LR, nodularin and TNF-α and human cancer development.

Anticancer Agents Med. Chem. 11(1) , 4-18, (2011)

Microcystin-LR and nodularin, along with okadaic acid, are potent inhibitors of protein phosphatases 1 and 2A (PP1 and PP2A). The mechanisms of action of microcystin-LR and nodularin in the liver and ...

 节球毒素英文别名

(2Z,5R,6S,9S,12S,13S,16R)-9-{3-[(diaminomethylidene)amino]propyl}-2-ethylidene-12-[(1E,3E,5S,6S)-6-methoxy-3,5-dimethyl-7-phenylhepta-1,3-dien-1-yl]-1,6,13-trimethyl-3,7,10,14,19-pentaoxo-1,4,8,11,15-pentaazacyclononadecane-5,16-dicarboxylic acid
Nodularin
(2Z,5R,6S,9S,12S,13S,16R)-9-(3-Carbamimidamidopropyl)-2-ethylidene-12-[(1E,3E,5S,6S)-6-methoxy-3,5-dimethyl-7-phenyl-1,3-heptadien-1-yl]-1,6,13-trimethyl-3,7,10,14,19-pentaoxo-1,4,8,11,15-pentaazacyclononadecane-5,16-dicarboxylic acid
1,4,8,11,15-Pentaazacyclononadecane-5,16-dicarboxylic acid, 9-[3-[(aminoiminomethyl)amino]propyl]-2-ethylidene-12-[(1E,3E,5S,6S)-6-methoxy-3,5-dimethyl-7-phenyl-1,3-heptadien-1-yl]-1,6,13-trimethyl-3,7,10,14,19-pentaoxo-, (2Z,5R,6S,9S,12S,13S,16R)-
Nodularin solution
1,4,8,11,15-Pentaazacyclononadecane,cyclic peptide
MFCD00165004
1,4,8,11,15-pentaazacyclononadecane-5,16-dicarboxylic acid, 9-[3-[(diaminomethylene)amino]propyl]-2-ethylidene-12-[(1E,3E,5S,6S)-6-methoxy-3,5-dimethyl-7-phenyl-1,3-heptadien-1-yl]-1,6,13-trimethyl-3,7,10,14,19-pentaoxo-, (2Z,5R,6S,9S,12S,13S,16R)-
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