| 中文名 | 新绿原酸 |
| 英文名 | [1R-(1α,3α,4α,5β)]-3-[[3-(3,4-dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexanecarboxylicacid |
| 别名 | 新绿原酸 5-咖啡奎宁酸 5-咖啡酰奎尼酸 5-二咖啡酰奎宁酸 新绿原酸(标准品) 新绿原酸(5-咖啡酰奎宁酸) 5-咖啡奎宁酸,5-咖啡酰奎尼酸 5-咖啡酰奎宁酸,5-咖啡酰奎尼酸 NEOCHLOROGENIC ACID 新绿原酸 |
| 英文别名 | Neochlorogenicacid 5-Caffeoylquinicacid 5-O-CAFFEOYLQUINICACID trans-5-O-Caffeoyl-D-quinate 3-{[3-(3,4-dihydroxyphenyl)acryloyl]oxy}-1,4,5-trihydroxycyclohexanecarboxylicacid (1R)-3β-[[3-(3,4-Dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1β,4β,5α-trihydroxycyclohexane-1α-carboxylicacid [1R-(1α,3α,4α,5β)]-3-[[3-(3,4-dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexanecarboxylicacid (1R,3R,4S,5R)-3-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,4,5-trihydroxycyclohexanecarboxylicacid (1R,3R,4S,5R)-5-[(E)-3-(3,4-Dihydroxyphenyl)prop-2-enoyl]oxy-1,3,4-trihydroxycyclohexane-1-carboxylicacid [1R-(1alpha,3alpha,4alpha,5beta)]-3-[[3-(3,4-dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexanecarboxylicacid |
| CAS | 906-33-2 |
| EINECS | 212-997-1 |
| 化学式 | C16H18O9 |
| 分子量 | 354.31 |
| InChI | InChI=1/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m1/s1 |
| InChIKey | CWVRJTMFETXNAD-NXLLHMKUSA-N |
| 密度 | 1.65±0.1 g/cm3(Predicted) |
| 熔点 | 204-206 °C (decomp) |
| 沸点 | 665.0±55.0 °C(Predicted) |
| 比旋光度 | -36° |
| 闪点 | 245.5°C |
| 蒸汽压 | 1.38E-18mmHg at 25°C |
| 溶解度 | DMSO (Slightly), Ethanol (Slightly, Heated, Sonicated), Methanol(Slightly, Heat |
| 折射率 | 1.69 |
| 酸度系数 | 3.90±0.50(Predicted) |
| 存储条件 | 2-8°C |
| 稳定性 | Hygroscopic |
| 外观 | neat |
| 颜色 | White to Off-White |
| 物化性质 | 易溶于热水、乙醇及丙酮，可完全溶解。极微溶于醋酸乙酯。 来源于金银花 |
| MDL号 | MFCD10566639 |
| 体外研究 | Neochlorogenic acid (NCA) shows a reduction of lipopolysaccharide(LPS)-induced NO production by suppressing iNOS and COX-2 proteinexpression and production of pro-inflammatory cytokines, such asTNF-α and IL-1β, in BV2 microglia cells. In addition,phosphorylated p38 MAPK and NF-κB p65 are also inhibited byNeochlorogenic acid in activated microglia. iNOS and COX-2 levelsare increased in LPS-induced BV2 cells, but this increase issignificantly inhibited after treatment with 50 and 100 μMNeochlorogenic acid. |
