简介名称和标识符别名信息物化性质安全信息相关文献参考资料相关分类相关产品

(Z)-蒿本内酯 | 81944-09-4

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中文名称： (Z)-蒿本内酯

英文名称： (Z)-Ligustilide

CAS No.： 81944-09-4

分子式： C₁₂H₁₄O₂

分子量： 190.238363742828

如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击：(Z)-蒿本内酯结构式

MSDS： (Z)-蒿本内酯MSDS

价格行情： (Z)-蒿本内酯价格

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(Z)-蒿本内酯的其他展现形式

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简介

(Z)-Ligustilide 是从 Ligusticum chuanxiong Hort 中提取的，具有抗菌和抗真菌活性，抗真菌评分为 5.6。 (Z)-Ligustilide 抑制 FATP5 和 DGAT 的表达，抑制小鼠脂肪酸的摄取和酯化，具有研究非酒精性脂肪性肝病 (NAFLD) 的潜力。

名称和标识符

MDL	MFCD01861511
InChIKey	IQVQXVFMNOFTMU-FLIBITNWSA-N
Inchi	1S/C12H14O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h5,7-8H,2-4,6H2,1H3/b11-8-
SMILES	C(=C1/OC(=O)C2C=CCCC/1=2)/CCC

别名信息

- 中文别名 -

蒿本内酯
3-丁烯基-4,5-二氢-1(3H)-异苯并呋喃酮
蒿本内酯(标准品)
蒿本内酯 A
zzstandard 品牌藁本内酯对照品

Z-藳本内酯
藁本内酯
藳本内酯
藁本内酯,Ligustilide,植物提取物,标准品,对照品
(Z)-蒿本内酯

- 英文别名 -

1(3H)-Isobenzofuranone, 3-butylidene-4,5-dihydro-, (3Z)-
3-BUTYLIDEN-4,5-DIHYDRO-3H-ISOBENZOFURAN-1-ONE
3-BUTYLIDENE-4,5-DIHYDROPHTHALIDE
LIGUSTILIDE, Z-
Z-LIGUSTILIDE

3-Butylidene-4,5-dihydro-1(3H)-isobenzofuranone
1(3H)-Isobenzofuranone,3-butylidene-4,5-dihydro-
(3Z)-3-Butylidene-4,5-dihydroisobenzofuran-1(3H)-one
Ligustilide
Ligustilide A
LIGUSTILLIDE A
(3Z)-3-Butylidene-4,5-dihydro-1(3H)-isobenzofuranone
1(3H)-Isobenzofuranone, 3-butylidene-4,5-dihydro-
KBio2_002182
Spectrum_001702
SpecPlus_000585
Spectrum4_001816
KBioSS_002182
KBioGR_002456
DivK1c_006681
KBio2_007318
KBio2_004750
KBio1_001625
3-butylidene-4,5-dihydro-2-benzofuran-1(3h)-one
1(3H)-Isobenzofuranone, 3-butylidene-4,5-dihydro-, (E)-
(Z)-Ligustilide
(Z)-3-Butylidene-4,5-dihydroisobenzofuran-1(3H)-one
(3Z)-3-butylidene-4,5-dihydro-2-benzofuran-1-one
cis-ligustilide
10HE68JD06
trans-ligustilide
Ligusticide
Ligustilide, (E)-
Spectrum5_000551
(3Z)-3-butylidene-4,5-dihydroisobenzofuran-1-one
(3Z)-3-Butylidene-4,5-dihydro-1(3H)-isobenzofuranone (ACI)
1(3H)-Isobenzofuranone, 3-butylidene-4,5-dihydro-, (Z)- (ZCI)
cis-Ligustilide
Z-Ligustilide
(Z)-ligustilide
Z-ligustilide

物化性质

实验特性

LogP	2.87380
PSA	26.30000
溶解度	微溶 (1.2 g/L) (25 ºC),
颜色与性状	A solution in ethanol
密度	1.10±0.1 g/cm3 (20 ºC 760 Torr),

计算特性

精确分子量	190.09900
氢键供体数量	0
氢键受体数量	2
可旋转化学键数量	2
同位素质量	190.099379685 g/mol
重原子数量	14
复杂度	345
同位素原子数量	0
确定原子立构中心数量	0
不确定原子立构中心数量	0
确定化学键立构中心数量	1
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）	2.7
拓扑分子极性表面积	26.3
分子量	190.24

安全信息

储存条件	Dry, dark and store at 0-4℃ for short term (days to weeks) or -20℃ for long term (Store correctly 2-3years).
信号词	Warning

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参考资料

Reaxys RN

(Z)-蒿本内酯 | 81944-09-4

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