284734
吲哚-3-羧酸
ReagentPlus®, 99%
别名:
β-吲哚羧酸, 3-吲哚甲酸, 3-吲哚羧酸, 3-羧基吲哚, 吲哚-β-羧酸
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关于此项目
经验公式（希尔记法）:
C9H7NO2
化学文摘社编号:
分子量:
161.16
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
212-231-6
Beilstein/REAXYS Number:
129435
MDL number:
InChI key
KMAKOBLIOCQGJP-UHFFFAOYSA-N
InChI
1S/C9H7NO2/c11-9(12)7-5-10-8-4-2-1-3-6(7)8/h1-5,10H,(H,11,12)
SMILES string
OC(=O)c1c[nH]c2ccccc12
product line
ReagentPlus®
assay
99%
form
solid
mp
232-234 °C (dec.) (lit.)
solubility
95% ethanol: soluble 5%, clear to slightly hazy, light yellow to yellow
General description
吲哚-3-羧酸衍生物的结构已采用高分辨质谱气相色谱（GC-HRMS）、超高效液相色谱结合高分辨率串联质谱（UHPLC-HRMS）、核磁共振光谱（NMR）和傅里叶变换红外光谱（FT-IR）进行了研究。
Application
作为反应物用于制备：
- 抗癌剂
- 氨基酸和肽的衍生物
- 5-羟色胺5-HT4受体拮抗剂
- 主要的酰基脲类
- 在Hedgehog途径中，Gli1介导的转录的抑制剂
- 5-羟色胺5-HT6拮抗剂
- 超晚期抗原-4（VLA-4）拮抗剂
- EphB3受体酪氨酸激酶抑制剂
- 阿尔茨海默病的潜在治疗药物
- 乙烯基酯假三肽蛋白酶体抑制剂
Legal Information
ReagentPlus is a registered trademark of Merck KGaA, Darmstadt, Germany
存储类别
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type N95 (US)
Analytical characterization of some synthetic cannabinoids, derivatives of indole-3-carboxylic acid.
Vadim Shevyrin et al.
Forensic science international, 232(1-3), 1-10 (2013-09-24)
By means of gas chromatography with high resolution mass spectrometry (GC-HRMS), ultra-high performance liquid chromatography in combination with high resolution tandem mass spectrometry (UHPLC-HRMS), nuclear magnetic resonance spectroscopy (NMR) and Fourier transform infrared spectroscopy (FT-IR), structure of a series from
Xuejin Zhao et al.
Viruses, 13(8) (2021-08-29)
Influenza A viruses are serious zoonotic pathogens that continuously cause pandemics in several animal hosts, including birds, pigs, and humans. Indole derivatives containing an indole core framework have been extensively studied and developed to prevent and/or treat viral infection. This
Paweł Bednarek
Current opinion in plant biology, 15(4), 407-414 (2012-03-27)
In plants, a host's responses to an attempted infection include activation of various secondary metabolite pathways, some of which are specific for particular plant phylogenetic clades. Phytochemicals that represent respective end products in plant immunity have been stereotypically linked to
J J Michnovicz et al.
Journal of the National Cancer Institute, 82(11), 947-949 (1990-06-06)
Dietary indoles in cruciferous vegetables induce cytochrome P450 enzymes and have prevented tumors in various animal models. Because estradiol metabolism is also cytochrome P450 mediated and linked to breast cancer risk, indoles may similarly reduce estrogen-responsive tumors in humans. We
Adelle A Vandersteen et al.
The Journal of organic chemistry, 77(15), 6505-6509 (2012-07-19)
Elucidation of the mechanism for decarboxylation of indolecarboxylic acids over a wide range of solution acidity reveals the importance of protonated carbonic acid (PCA) as a reaction intermediate. In concentrated acid, the initial addition of water to the carboxyl group
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