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黄芩苷 | 21967-41-9

黄芩苷
Baicalin
21967-41-9
C21H18O11
446.3610
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:黄芩苷结构式
黄芩苷MSDS
24880654
黄芩苷价格
简介
Baicalin 作为一种类黄酮糖苷,是一种变构肉碱棕榈酰转移酶1 (CPT1)是激活剂。Baicalin 降低 NF-κB 表达。
名称和标识符
MDL MFCD00149302
InChIKey IKIIZLYTISPENI-ZFORQUDYSA-N
Inchi 1S/C21H18O11/c22-9-6-10(8-4-2-1-3-5-8)30-11-7-12(14(23)15(24)13(9)11)31-21-18(27)16(25)17(26)19(32-21)20(28)29/h1-7,16-19,21,23-27H,(H,28,29)/t16-,17-,18+,19-,21+/m0/s1
SMILES O1[C@]([H])(C(=O)O[H])[C@]([H])([C@@]([H])([C@]([H])([C@]1([H])OC1=C(C(=C2C(C([H])=C(C3C([H])=C([H])C([H])=C([H])C=3[H])OC2=C1[H])=O)O[H])O[H])O[H])O[H])O[H]
别名信息
- 中文别名 -
  • 黄芩苷
  • 贝加灵
  • 黄芩甙
  • 黄芩素
  • 黄芩苷BAICALIN
  • (7-黄芩苷)-Β-D-葡萄糖苷酸
  • 1-[(5-乙基-2-噻吩)甲基]哌嗪
  • 穿琥宁
  • 葛根提取物
  • 黄岑提取物
  • 黄芩甙标准品(JP)
  • 黄芩苷 EP标准品
  • 黄芩苷(P)
  • 黄芩苷 植物提取物,标准品,对照品
  • 黄芩苷对照品
  • 黄芩苷粉
  • 黄芩提取物
  • 柠檬粉
  • 黄岑甙
  • 黄苓甙
  • 黄芩苷 标准品
  • 黄芩素-7-O-β-D-葡萄糖醛酸苷
  • 秦皮甲素
  • 秦皮素
  • 秦皮乙素
  • 野黄芩苷
  • 5,6-二羟基-4-氧代-2-苯基-4H-1-苯并吡喃-7-基-D-葡糖苷酸
  • 哈密瓜提取物
  • 中药黄芩提取物
  • 黄芩苷(分析标准品)
  • 黄芩苷85%
- 英文别名 -
  • Baicalin
  • BAICALEIN 7-BETA-D-GLUCOPYRANOSIDURONATE HYDRATE
  • BAICALIN 7-BETA-D-GLUCOPYRANOSIDURONATE HYDRATE
  • BAICALIN HYDRATE
  • Baicalin Injection
  • Bassora
  • Radix
  • ASTRAGALIN(KAEMPFEROL-3-O-GLUCOSIDE)(P)
  • BAICALIN(P)
  • 7-GLUCURONICACID-5,6-DIHYDROXYFLAVONE
  • BAICALIN WITH HPLC
  • BAICALIN hplc
  • 5,6-Dihydroxy-4-oxygen-2-phenyl-4H-1-benzopyran-7-beta-D-glucopyranose acid
  • Baicalein 7-O-glucuronide
  • BAICALINB-D-GLUCOPYRANOSIDURONIC ACID, 5,6-DIHYDROXY-4-OXO-2-PHENYL-4H-1-BENZOPYRAN-7-YL
  • BAICALIN 7-B-D-GLUCOPYRANOSIDURONATE HYDRATE
  • 5,6-Dihydroxy-7-(β-D-glucopyranuronosyloxy)flavone
  • 5,6-Dihydroxyflavon-7-yl β-D-glucopyranosiduronic acid
  • Baicalein 7-O-β-D-glucuronide
  • BAICALIN(AS)
  • BAICALIN(P) PrintBack
  • 5,6-Dihydroxy-4-oxo-2-phenyl-4H-1-benzopyran-7-yl β-D-Glucopyranosiduronic Acid
  • Baicailin
  • Baicaloside
  • WAKO024-15691
  • 5,6-Dihydroxy-4-oxo-2-phenyl-4H-1-benzopyran-7-yl-β-D-glucopyranosiduronic acid
  • [ "" ]
  • Cantaloupe extract.
  • Scutellana baicalensis Georgi
  • 7-D-Glucuronic acid-5,6-dihydroxyflavone
  • Baicalein 7-O-
  • A-D-glucuronide
  • 5,6-dihydroxy-4-oxo-2-phenyl-4H-chromen-7-yl beta-D-glucopyranosiduronic acid
  • 347Q89U4M5
  • (2S,3S,4S,5R,6S)-6-((5,6-dihydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
  • 5,6,7-trihydroxyflavone 7-O-beta-D-glucuronide
  • beta-D-Glucopyranosiduronic acid, 5,6-dihydroxy-4-o
  • 0XE
  • NCGC00386028-03
  • UNII-347Q89U4M5
  • baikalin
  • 31564-28-0
  • TJN-151
  • Baicalin, >=99.0% (HPLC)
  • AKOS015955933
  • AS-13226
  • BAICALIN [INCI]
  • Baicalein 7-beta-D-glucopyranosiduronate
  • AM84780
  • Baicalin, 95%
  • Baicalein-7-D-glucuronide
  • beta-D-Glucopyranosiduronic acid, 5,6-dihydroxy-4-oxo-2-phenyl-4H-1-benzopyran-7-yl
  • AC-7990
  • (2S,3S,4S,5R,6S)-6-(5,6-DIHYDROXY-4-OXO-2-PHENYL-CHROMEN-7-YL)OXY-3,4,5-TRIHYDROXY-OXANE-2-CARBOXYLIC ACID
  • CHEBI:2981
  • CHEMBL485818
  • 7-D-glucuronic acid-5,6-dihydroxy-flavone
  • 5,6-Dihydroxy-4-oxo-2-phenyl-4H-1-benzopyran-7-yl
  • A-D-Glucopyranosiduronic Acid
  • HY-N0197
  • BDBM50242173
  • BAICALIN [WHO-DD]
  • AKOS007930529
  • Baicalin, European Pharmacopoeia (EP) Reference Standard
  • CS-5302
  • 5,6,7-Trihydroxyflavone-7-O-.beta.-D-glucopyranosideuronic acid
  • 21967-41-9
  • (2S,3S,4S,5R,6S)-6-(5,6-dihydroxy-4-oxo-2-phenylchromen-7-yl)oxy-3,4,5-trihydroxyoxane-2-carboxylicacid
  • BAICALEIN 7-O-BETA-D-GLUCURONIDE
  • CCG-214128
  • Baicalein 7-O-b-D-glucuronide
  • J-013512
  • Q-100275
  • DTXSID701346569
  • BAICALEIN 7-O-GLUCURONIDE [USP-RS]
  • (2S,3S,4S,5R,6S)-6-(5,6-dihydroxy-4-oxo-2-phenyl-chromen-7-yl)oxy-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
  • (2S,3S,4S,5R,6S)-6-(5,6-dihydroxy-4-oxo-2-phenyl-4H-chromen-7-yloxy)-3,4,5-trihydroxy-tetrahydro-2H-pyran-2-carboxylic acid
  • Baicalein 7-O-.beta.-D-glucuronide
  • BAICALIN 7-B-D-GLUCURONIDE
  • BAICALIN [VANDF]
  • 5,6-dihydroxy-4-oxo-2-phenyl-4H-1-benzopyran-7-yl beta-D-glucopyranosiduronic acid
  • NS00097648
  • .BETA.-D-GLUCOPYRANOSIDURONIC ACID, 5,6-DIHYDROXY-4-OXO-2-PHENYL-4H-1-BENZOPYRAN-7-YL
  • PD132941
  • Baicalin 1000 microg/mL in Methanol
  • BRD-K49962337-001-01-1
  • (2S,3S,4S,5R,6S)-6-[(5,6-dihydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
  • Baicalin,(S)
  • (2S,3S,4S,5R,6S)-6-(5,6-dihydroxy-4-oxo-2-phenyl-4H-chromen-7-yloxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
  • (2S,3S,4S,5R,6R)-6-(5,6-dihydroxy-4-oxo-2-phenyl-chromen-7-yl)oxy-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
  • MFCD00134418
  • SCHEMBL285082
  • IKIIZLYTISPENI-ZFORQUDYSA-N
  • Baicalein 7-beta-D-glucuronide
  • 1ST40031
  • Baicalein 7-glucuronide
  • Q2879368
  • A815791
  • BAICALEIN 7-O-GLUCURONIDE (USP-RS)
  • MLS000563431
  • (2r,3r,4s,5r,6s)-6-[(5,6-dihydroxy-4-oxo-2-phenylchromen-7-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
  • SMR000232281
  • 5,6,7-Trihydroxyflavone 7-glucuronide
  • (2R,3R,4S,5R,6S)-6-[(5,6-dihydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
  • MLSMR
  • MLS006011777
  • 7-D-glucuronic acid-5,6-dihydroxyflavone
  • Baicalin 85%
物化性质
实验特性
LogP 0.14220
PSA 187.12000
折射率 1.739
沸点 836.6℃/760mmHg
熔点 202-205 °C (dec.) (lit.)
闪点 297.2±27.8 °C
溶解度 生物体外In Vitro:DMSO溶解度≥ 100 mg/mL(224.03 mM)H2O< 0.1 mg/mL(insoluble)*"≥" means soluble可溶, but saturation unknown溶解度未知.
颜色与性状 Yellow powder
比旋光度 -85 º (c=1, DMSO)
光学活性 [α]20/D −85°, c = 1 in DMSO
密度 1.7370
计算特性
精确分子量 446.08500
氢键供体数量 6
氢键受体数量 11
可旋转化学键数量 4
同位素质量 446.08491139 g/mol
重原子数量 32
复杂度 748
同位素原子数量 0
确定原子立构中心数量 5
不确定原子立构中心数量 0
确定化学键立构中心数量 0
不确定化学键立构中心数量 0
共价键单元数量 1
疏水参数计算参考值(XlogP) 1.1
互变异构体数量 10
表面电荷 0
拓扑分子极性表面积 183
分子量 446.4
国际标准相关数据
EINECS 24880654
海关数据
海关编码 29329990
生产方法和用途
用途
用于治疗传染性肝炎、急性黄疸型及慢性肝炎、急性胆道感染、铅中毒等病症
具有广谱抗菌作用,还有利胆、抗炎、抗变态反应、解热、解毒、利尿、降压等作用。临床上用于治疗传染性肝炎,对降低肝炎活动期中谷丙转氨酶有较好疗效,还用叶于治疗中风和瘫痪,可降低脑血管阻力,增加脑血流量,提高血脑屏障通透性及对抗由磷酸腺苷引起的血小板凝集作用。
专业数据库参考
PubChemId 24880654
参考资料
Reaxys RN 70480
Beilstein 18(3/4)5154
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