| 货号 (SKU) | 包装规格 | 是否现货 | 价格 | 数量 |
|---|---|---|---|---|
| C107325-20mg |
20mg |
现货  |
|
| 别名 | (2R,3R)-2,3-双[[(E)-3-(3,4-二羟基苯基)丙-2-烯酰]氧]丁二酸 |
|---|---|
| 英文别名 | CAS-70831-56-0 | Chicoric acid | MFCD00189418 | Cichoric acid;Dicaffeoyltartaric acid | (2R,3R)-2,3-Bis-[(E)-3-(3,4-dihydroxy-phenyl)-acryloyloxy]-succinic acid | D78144 | NCGC00258608-01 | (2R,3R)-2,3-bis((E)-3-(3,4-dihydroxyphenyl)acryloyloxy)succinic a |
| 规格或纯度 | 分析标准品, ≥98% |
| 英文名称 | (-)-Chicoric acid |
| 储存温度 | 2-8°C储存 |
| 运输条件 | 冰袋运输 |
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| 作用机制 | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | 参考文献 |
|---|
| 分子类型 | 小分子 |
|---|---|
| IUPAC Name | (2R,3R)-2,3-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]butanedioic acid |
| INCHI | InChI=1S/C22H18O12/c23-13-5-1-11(9-15(13)25)3-7-17(27)33-19(21(29)30)20(22(31)32)34-18(28)8-4-12-2-6-14(24)16(26)10-12/h1-10,19-20,23-26H,(H,29,30)(H,31,32)/b7-3+,8-4+/t19-,20-/m1/s1 |
| InChi Key | YDDGKXBLOXEEMN-IABMMNSOSA-N |
| Canonical SMILES | C1=CC(=C(C=C1C=CC(=O)OC(C(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)C(=O)O)O)O |
| Isomeric SMILES | C1=CC(=C(C=C1/C=C/C(=O)O[C@@H](C(=O)O)[C@@H](OC(=O)/C=C/C2=CC(=C(C=C2)O)O)C(=O)O)O)O |
| PubChem CID | 5281764 |
| 分子量 | 474.37 |
| 密度 | 1.641 |
|---|---|
| 分子量 | 474.400 g/mol |
| XLogP3 | 2.000 |
| 氢键供体数Hydrogen Bond Donor Count | 6 |
| 氢键受体数Hydrogen Bond Acceptor Count | 12 |
| 可旋转键计数Rotatable Bond Count | 11 |
| 精确质量Exact Mass | 474.08 Da |
| 单同位素质量Monoisotopic Mass | 474.08 Da |
| 拓扑极表面积Topological Polar Surface Area | 208.000 Ų |
| 重原子数Heavy Atom Count | 34 |
| 形式电荷Formal Charge | 0 |
| 复杂度Complexity | 740.000 |
| 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 | 2 |
| 未定义的原子立体中心计数Undefined Atom Stereocenter Count | 0 |
| 定义的键立体中心计数Defined Bond Stereocenter Count | 2 |
| 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 | 2 |
| 共价键合单元计数Covalently-Bonded Unit Count | 1 |
| 象形图 | GHS08, GHS07 |
|---|---|
| 信号词 | Danger |
| 危险声明 |
H302: 吞食有害 H317: 可能引起皮肤过敏反应 H334: 吸入可能引起过敏或哮喘病症状或呼吸困难 |
| 预防措施声明 |
P261: 避免吸入灰尘/烟雾/气体/雾/蒸汽/喷雾 P280: 戴防护手套/穿防护服/戴防护眼罩/戴防护面具。 P302+P352: 如皮肤沾染：用水充分清洗。 P321: 特殊处理（请参阅此标签上的...）。 P501: 将内容物/容器处理到。。。 P264: 处理后要彻底洗手。 P284: 如果通风不良，请佩戴呼吸防护装置。 P270: 使用本产品时，请勿进食、饮水或吸烟。 P304+P340: 如误吸入：将人转移到空气新鲜处，保持呼吸舒适体位。 P272: 被污染的工作服不允许离开工作场所 P333+P313: 如发生皮肤刺激或皮疹：求医/就诊。 P362+P364: 脱掉沾污的衣服，清洗后方可重新使用。 P330: 漱口 P301+P317: 如果被吞咽：请寻求医疗帮助。 P342+P316: 如果出现呼吸道症状：立即寻求急救。 |
| Hydrogen | 3.67-3.95（%） |
|---|---|
| Carbon | 53.44-57.9（%） |
| Purity(HPLC) | 98-100（%） |
| Appearance（C107325) | White to Off-White Powder or Crystals |
| Proton NMR spectrum | Conforms to Structure |
| Specific Rotation [a]25/D(c=1 in MeOH) | -336--330（°） |
| 1. Binshuai Li, Xinran Liu, Mengai Yin, Lan Xue, Lina Lu, Fuju Dai, Wei Feng, Shengnan Yang, Jun Jiao, Qiang Chen. (2022) An Electrochemical Biosensor for Detection of Cichoric Acid as an Anti-Alzheimer’s Disease Agent in Chicory Samples Based on Setaria-Like Trimetallic Nanodendrites Decorated NH2-RGO Flakes. JOURNAL OF THE ELECTROCHEMICAL SOCIETY, 169 (4): (46524). [10.1149/1945-7111/ac68a4] |
| 2. Ji Ma, Maoru Li, Praveen Kumar Kalavagunta, Jiajing Li, Qiangqiang He, Yifan Zhang, Owais Ahmad, Hongli Yin, Tao Wang, Jing Shang. (2018) Protective effects of cichoric acid on H2O2-induced oxidative injury in hepatocytes and larval zebrafish models. BIOMEDICINE & PHARMACOTHERAPY, 104 (679). [PMID:29803928] [10.1016/j.biopha.2018.05.081] |
| 3. Yi Hao, Ruixia Gao, Dechun Liu, Gaiyan He, Yuhai Tang, Zengjun Guo. (2016) Selective extraction and determination of chlorogenic acid in fruit juices using hydrophilic magnetic imprinted nanoparticles. FOOD CHEMISTRY, 200 (215). [PMID:26830581] [10.1016/j.foodchem.2016.01.004] |
| 1. Binshuai Li, Xinran Liu, Mengai Yin, Lan Xue, Lina Lu, Fuju Dai, Wei Feng, Shengnan Yang, Jun Jiao, Qiang Chen. (2022) An Electrochemical Biosensor for Detection of Cichoric Acid as an Anti-Alzheimer’s Disease Agent in Chicory Samples Based on Setaria-Like Trimetallic Nanodendrites Decorated NH2-RGO Flakes. JOURNAL OF THE ELECTROCHEMICAL SOCIETY, 169 (4): (46524). [10.1149/1945-7111/ac68a4] |
| 2. Ji Ma, Maoru Li, Praveen Kumar Kalavagunta, Jiajing Li, Qiangqiang He, Yifan Zhang, Owais Ahmad, Hongli Yin, Tao Wang, Jing Shang. (2018) Protective effects of cichoric acid on H2O2-induced oxidative injury in hepatocytes and larval zebrafish models. BIOMEDICINE & PHARMACOTHERAPY, 104 (679). [PMID:29803928] [10.1016/j.biopha.2018.05.081] |
| 3. Yi Hao, Ruixia Gao, Dechun Liu, Gaiyan He, Yuhai Tang, Zengjun Guo. (2016) Selective extraction and determination of chlorogenic acid in fruit juices using hydrophilic magnetic imprinted nanoparticles. FOOD CHEMISTRY, 200 (215). [PMID:26830581] [10.1016/j.foodchem.2016.01.004] |
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