Details
Stereochemistry | ACHIRAL |
Molecular Formula | C20H18NO4.Cl |
Molecular Weight | 371.814 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Cl-].COC1=C(OC)C=C2C(CC[N+]3=CC4=C(C=CC5=C4OCO5)C=C23)=C1
InChI
InChIKey=DGRBIBRPLDAHJH-UHFFFAOYSA-M
InChI=1S/C20H18NO4.ClH/c1-22-18-8-13-5-6-21-10-15-12(3-4-17-20(15)25-11-24-17)7-16(21)14(13)9-19(18)23-2;/h3-4,7-10H,5-6,11H2,1-2H3;1H/q+1;/p-1
Approval Year
Targets
Primary Target | Pharmacology | Condition | Potency |
---|---|---|---|
Target ID: CHEMBL210 Sources: https://www.ncbi.nlm.nih.gov/pubmed/30155694 |
2.3 µM [IC50] | ||
Target ID: CHEMBL2096989 Sources: https://www.ncbi.nlm.nih.gov/pubmed/30391811 |
|||
Target ID: CHEMBL289 Sources: https://www.ncbi.nlm.nih.gov/pubmed/29343943 |
25.44 µM [Ki] | ||
Target ID: CHEMBL3397 Sources: https://www.ncbi.nlm.nih.gov/pubmed/29343943 |
5.64 µM [Ki] |
PubMed
Title | Date | PubMed |
---|---|---|
[Determination of six alkaloids in six types of Coptidis Rhizoma pieces by RP-HPLC and spectrum-effect relationships with anti-diabetes pharmacodynamics data]. | 2016 Dec |
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Transcriptome analyses provide insights into the difference of alkaloids biosynthesis in the Chinese goldthread (Coptis chinensis Franch.) from different biotopes. | 2017 |
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Inhibition activity of a traditional Chinese herbal formula Huang-Lian-Jie-Du-Tang and its major components found in its plasma profile on neuraminidase-1. | 2017 Nov 14 |
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Discovery of novel antagonists on β(2)-adrenoceptor from natural products using a label-free cell phenotypic assay. | 2018 Dec |
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Rapid and simultaneous analysis of five alkaloids in four parts of Coptidis Rhizoma by near-infrared spectroscopy. | 2018 Jan 5 |
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Comparative pharmacokinetics study of five alkaloids in rat plasma and related compound-herb interactions mechanism after oral administration of Shuanghua Baihe tablets. | 2018 Sep |
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Ligand Selectivity in the Recognition of Protoberberine Alkaloids by Hybrid-2 Human Telomeric G-Quadruplex: Binding Free Energy Calculation, Fluorescence Binding, and NMR Experiments. | 2019 Apr 21 |
|
Molecular Recognition of the Hybrid-Type G-Quadruplexes in Human Telomeres. | 2019 Apr 22 |
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71467079
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ND559X5J59
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889665-86-5
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admin on Sat Dec 16 19:01:08 GMT 2023 , Edited by admin on Sat Dec 16 19:01:08 GMT 2023
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ACTIVE MOIETY
SUBSTANCE RECORD