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-trihydroxycyclohexanecarboxylic acid |
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 | Neochlorogenic acid 5-Caffeoylquinic acid 5-O-CAFFEOYLQUINICACID trans-5-O-Caffeoyl-D-quinate 3-{[3-(3,4-dihydroxyphenyl)acryloyl]oxy}-1,4,5-trihydroxycyclohexanecarboxylic acid (1R)-3β-[[3-(3,4-Dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1β,4β,5α-trihydroxycyclohexane-1α-carboxylic acid [1R-(1α,3α,4α,5β)]-3-[[3-(3,4-dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexanecarboxylic acid (1R,3R,4S,5R)-3-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,4,5-trihydroxycyclohexanecarboxylic acid (1R,3R,4S,5R)-5-[(E)-3-(3,4-Dihydroxyphenyl)prop-2-enoyl]oxy-1,3,4-trihydroxycyclohexane-1-carboxylic acid [1R-(1alpha,3alpha,4alpha,5beta)]-3-[[3-(3,4-dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexanecarboxylic acid |
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 (微溶),乙醇 (微溶,加热,超声处理),甲醇 (微溶,加热 |
折射率 | 1.69 |
酸度系数 | 3.90±0.50(Predicted) |
存储条件 | 2-8°C |
稳定性 | 吸湿性 |
外观 | 整洁 |
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 protein expression and production of pro-inflammatory cytokines, such as TNF-α and IL-1β, in BV2 microglia cells. In addition, phosphorylated p38 MAPK and NF-κB p65 are also inhibited by Neochlorogenic acid in activated microglia. iNOS and COX-2 levels are increased in LPS-induced BV2 cells, but this increase is significantly inhibited after treatment with 50 and 100 μM Neochlorogenic acid. |
WGK Germany | 3 |
海关编号 | 29182900 |
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新绿原酸是一种天然有机酸,也被称为咖啡酸。以下是关于新绿原酸的性质、制法和安全信息的介绍:
性质:
1、外观:新绿原酸为白色结晶粉末或无色结晶。
2、可溶性:在水、乙醇、氯仿和醚中可溶,稍溶于乙醚。
3、稳定性:新绿原酸对光、热和酸性环境相对稳定,但易被氧化。
制法:
新绿原酸常通过天然植物提取或化学合成获得。在植物提取方法中,常从咖啡豆、苹果、樱桃等植物中提取得到。而化学合成方法则是通过有机合成反应合成新绿原酸。
安全信息:
1、一般认为是相对安全的,但使用时仍需注意合理用量。
2、避免吸入或接触粉末形式的新绿原酸,以防止刺激眼睛、皮肤和呼吸道。
3、长期或大量接触可能导致过敏反应或皮肤刺激,故需注意个人防护措施。
4、如误服或误接触大量新绿原酸,请尽快就医,并带上产品包装物进行处理。
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