Description of the Component
Component ID |
TCMH2640 |
Latin Name |
Valeriana jatamansii |
English Name |
Jatamans valeriana |
Chinese Pinyin Name |
Zhi Zhu Xiang |
中文名 |
蜘蛛香 |
TCM Properties |
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TCM Meridians |
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Therapeutic Class English |
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Therapeutic Class Chinese |
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Functions |
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Toxicity |
NA |
Geo-authentic habitats (道地产区) |
NA |
Reference |
CFDA |
Barcode ID |
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Barcode Source |
Targeted Human Proteins by the Ingredient of Component
| Target ID | Gene Symbol | Target Name | Target Class | Uniprot ID |
|---|---|---|---|---|
| TCMT1 | EHMT2 | Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 | Transferase | Q96KQ7 |
| TCMT100 | TTR | Transthyretin | Unclassified | P02766 |
| TCMT101 | PTPN1 | Protein-tyrosine phosphatase 1B | Hydrolase | P18031 |
| TCMT11 | HIF1A | Hypoxia-inducible factor 1 alpha | Transcription factor | Q16665 |
| TCMT13 | APEX1 | DNA-(apurinic or apyrimidinic site) lyase | Lyase | P27695 |
| TCMT130 | ALOX5 | Arachidonate 5-lipoxygenase | Oxidoreductase | P09917 |
| TCMT131 | ACHE | Acetylcholinesterase | Hydrolase | P22303 |
| TCMT133 | CA1 | Carbonic anhydrase I | Lyase | P00915 |
| TCMT134 | CA2 | Carbonic anhydrase II | Lyase | P00918 |
| TCMT135 | CA14 | Carbonic anhydrase XIV | Lyase | Q9ULX7 |
| TCMT136 | CA12 | Carbonic anhydrase XII | Lyase | O43570 |
| TCMT137 | CA9 | Carbonic anhydrase IX | Lyase | Q16790 |
| TCMT138 | CA7 | Carbonic anhydrase VII | Lyase | P43166 |
| TCMT139 | CA6 | Carbonic anhydrase VI | Lyase | P23280 |
| TCMT140 | CA5B | Carbonic anhydrase VB | Lyase | Q9Y2D0 |
| TCMT141 | CA5A | Carbonic anhydrase VA | Lyase | P35218 |
| TCMT142 | CA4 | Carbonic anhydrase IV | Lyase | P22748 |
| TCMT143 | CA3 | Carbonic anhydrase III | Lyase | P07451 |
| TCMT159 | TYR | Tyrosinase | Oxidoreductase | P14679 |
| TCMT161 | HCAR2 | Hydroxycarboxylic acid receptor 2 | GPCR | Q8TDS4 |
| TCMT162 | UGT1A1 | UDP-glucuronosyltransferase 1-1 | Transferase | P22309 |
| TCMT166 | AKR1C2 | Aldo-keto reductase family 1 member C2 | Oxidoreductase | P52895 |
| TCMT167 | AKR1C3 | Aldo-keto-reductase family 1 member C3 | Oxidoreductase | P42330 |
| TCMT168 | AKR1C4 | Aldo-keto reductase family 1 member C4 | Oxidoreductase | P17516 |
| TCMT17 | POLB | DNA polymerase beta | Transferase | P06746 |
| TCMT18 | GAA | Lysosomal alpha-glucosidase | Hydrolase | P10253 |
| TCMT189 | DUSP3 | Dual specificity protein phosphatase 3 | Hydrolase | P51452 |
| TCMT2 | MAPT | Microtubule-associated protein tau | Unclassified | P10636 |
| TCMT223 | AKR1B1 | Aldose reductase | Oxidoreductase | P15121 |
| TCMT280 | AKR1B10 | Aldo-keto reductase family 1 member B10 | Oxidoreductase | O60218 |
| TCMT295 | MMP1 | Matrix metalloproteinase-1 | Hydrolase | P03956 |
| TCMT306 | MMP2 | Matrix metalloproteinase-2 | Hydrolase | P08253 |
| TCMT321 | MMP9 | Matrix metalloproteinase 9 | Hydrolase | P14780 |
| TCMT33 | CYP3A4 | Cytochrome P450 3A4 | Oxidoreductase | P08684 |
| TCMT423 | EGFR | Epidermal growth factor receptor erbB1 | Kinase | P00533 |
| TCMT45 | APP | Beta amyloid A4 protein | Unclassified | P05067 |
| TCMT6 | NFKB1 | Nuclear factor NF-kappa-B p105 subunit | Transcription factor | P19838 |
| TCMT69 | THRB | Thyroid hormone receptor beta-1 | Nuclear receptor | P10828 |
| TCMT8 | KDM4E | Lysine-specific demethylase 4D-like | Oxidoreductase | B2RXH2 |
| TCMT80 | MAPK1 | MAP kinase ERK2 | Kinase | P28482 |
| TCMT82 | ESR1 | Estrogen receptor alpha | Nuclear receptor | P03372 |
| TCMT87 | CYP2C9 | Cytochrome P450 2C9 | Oxidoreductase | P11712 |
| TCMT95 | MPG | DNA-3-methyladenine glycosylase | Hydrolase | P29372 |
Targeted Pathogenic Microbes by the Ingredient of Component
| Target ID | Target Name |
|---|---|
| TCMT1108 | Integrase |
| TCMT1218 | Staphylococcus aureus |
| TCMT1251 | Candida albicans |
| TCMT1346 | Helicobacter pylori |
| TCMT1454 | Bacillus subtilis |
| TCMT1462 | Streptococcus mutans |
Ingredient Structrues
Ingredient ID: TCMC897
Formula: C16H18O9
Ingredient ID: TCMC847
Formula: C9H8O4
Ingredient ID: TCMC5939
Formula: C15H24
Ingredient ID: TCMC5781
Formula: C26H36O12
Ingredient ID: TCMC5540
Formula: C15H26O
Ingredient ID: TCMC5420
Formula: C21H34O11
Ingredient ID: TCMC4694
Formula: C33H40O14
Ingredient ID: TCMC4533
Formula: C28H32O14
Ingredient ID: TCMC4484
Formula: C24H32O10
Ingredient ID: TCMC4162
Formula: C10H18O
Ingredient ID: TCMC3894
Formula: C22H30O8
Ingredient ID: TCMC3825
Formula: C10H16
Ingredient ID: TCMC3810
Formula: C10H18O
Ingredient ID: TCMC3323
Formula: C22H30O8
Ingredient ID: TCMC3209
Formula: C24H32O10
Ingredient ID: TCMC3093
Formula: C21H42O2
Ingredient ID: TCMC2932
Formula: C10H14
Ingredient ID: TCMC2896
Formula: C12H20O2
Ingredient ID: TCMC284
Formula: C10H16
Ingredient ID: TCMC2324
Formula: C10H16
Ingredient ID: TCMC182
Formula: C9H8O4
Properties
| Ingredient ID | Formulae | Name | MW | AlogP | MlogP | XlogP | # HBA | # HBD | PSA | # Rotatable Bond | # Ring | # Heacy Atom | Lipinski RO5 Violation |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TCMC182 | C9H8O4 | (Z)-3-(3,4-Dihydroxyphenyl)Prop-2-Enoic Acid | 180.04 | -0.7993 | 2.01 | 1.141 | 2 | 3 | 77.76 | 5 | 1 | 13 | 0 |
| TCMC284 | C10H16 | 1-Methyl-4-Prop-1-En-2-Ylcyclohexene | 136.13 | 2.1424 | 2.56 | 3.729 | 0 | 0 | 0 | 3 | 1 | 10 | 0 |
| TCMC847 | C9H8O4 | Caffeic Acid | 180.04 | -0.7993 | 2.01 | 1.141 | 2 | 3 | 77.76 | 5 | 1 | 13 | 0 |
| TCMC897 | C16H18O9 | Chlorogenic Acid | 354.1 | -2.1962 | 2.23 | -0.447 | 7 | 6 | 164.75 | 11 | 2 | 25 | 1 |
| TCMC2324 | C10H16 | Limonene | 136.13 | 2.1424 | 2.56 | 3.729 | 0 | 0 | 0 | 3 | 1 | 10 | 0 |
| TCMC2896 | C12H20O2 | 1,7,7-Trimethylbicyclo[2.2.1]Heptan-2-Yl Acetate,Bornyl Acetate | 196.1463299 | 1.3223 | 2.56 | 3.474 | 2 | 0 | 26.3 | 2 | 2 | 14 | 0 |
| TCMC2932 | C10H14 | P-Cymol,P-Cymene,Umbelliferone | 134.1095504 | 1.2149 | 2.56 | 5.785 | 0 | 0 | 0 | 1 | 1 | 10 | 1 |
| TCMC3093 | C21H42O2 | Methyl Eicosanoate | 326.3184806 | -4.7987 | 3.55 | 10.167 | 2 | 0 | 26.3 | 19 | 0 | 23 | 2 |
| TCMC3209 | C24H32O10 | Acevaltrate | 480.1995472 | 0.1212 | 3 | 2.464 | 10 | 0 | 126.96 | 13 | 3 | 34 | 1 |
| TCMC3323 | C22H30O8 | Isovaltrate | 422.1940679 | 0.1812 | 3 | 3.056 | 8 | 0 | 100.66 | 11 | 3 | 30 | 1 |
| TCMC3810 | C10H18O | Borneol | 154.1357652 | 0.9432 | 2.45 | 2.734 | 1 | 1 | 20.23 | 0 | 2 | 11 | 0 |
| TCMC3825 | C10H16 | Α-Pinene | 136.1252005 | 1.5162 | 2.56 | 4.177 | 0 | 0 | 0 | 0 | 1 | 10 | 0 |
| TCMC3894 | C22H30O8 | Valepotriate | 422.1940679 | 0.1812 | 3 | 3.056 | 8 | 0 | 100.66 | 11 | 3 | 30 | 1 |
| TCMC4162 | C10H18O | Borneol | 154.1357652 | 0.9432 | 2.45 | 2.734 | 1 | 1 | 20.23 | 0 | 2 | 11 | 0 |
| TCMC4484 | C24H32O10 | Acevaltratum | 480.1995472 | 0.1212 | 3 | 2.464 | 10 | 0 | 126.96 | 13 | 3 | 34 | 1 |
| TCMC4533 | C28H32O14 | Acacini,Linarin | 592.1792057 | -4.1028 | 3 | -0.297 | 10 | 7 | 204.83 | 7 | 5 | 42 | 1 |
| TCMC4694 | C33H40O14 | Linarin Isovalerate | 660.241806 | -2.9032 | 3.55 | 1.516 | 10 | 5 | 190.67 | 11 | 5 | 47 | 1 |
| TCMC5420 | C21H34O11 | Valerosidatum | 462.2101119 | -2.8509 | 2.56 | -0.25 | 11 | 6 | 175.37 | 8 | 3 | 32 | 2 |
| TCMC5540 | C15H26O | Maalialcohol | 222.1983655 | 0.9326 | 3 | 5.176 | 1 | 1 | 20.23 | 0 | 3 | 16 | 1 |
| TCMC5781 | C26H36O12 | 10-Acetoxy-1-Acevaltrate Hydrin | 540.2206766 | -0.2662 | 3 | 2.186 | 12 | 1 | 160.96 | 16 | 2 | 38 | 2 |
| TCMC5939 | C15H24 | Β-Patchoulene | 204.1878008 | 2.0475 | 3.11 | 5.743 | 0 | 0 | 0 | 0 | 3 | 15 | 1 |
Download Data
All data can be downloaded by:→ Selecting data type in the below download table
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