Component ID |
TCMH430 |
Latin Name |
Canavalia gladiata |
English Name |
Sword jackbean |
Chinese Pinyin Name |
Dao Dou |
中文名 |
刀豆 |
TCM Properties |
|
TCM Meridians |
|
Therapeutic Class English |
Regulation of qi |
Therapeutic Class Chinese |
理气 |
Functions |
warm the stomach and check its upward adverse movement |
Toxicity |
NA |
Geo-authentic habitats (道地产区) |
NA |
Reference |
CFDA |
Barcode ID |
ITSAK2636-14 |
Barcode Source |
BOLDSYSTEMS |
Prescription ID | Prescription English Name | Prescription Chinese Name |
---|---|---|
TCMFx5572 | Wei Bing Pills | 胃病丸 |
Target ID | Gene Symbol | Target Name | Target Class | Uniprot ID |
---|---|---|---|---|
TCMT1 | EHMT2 | Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 | Transferase | Q96KQ7 |
TCMT17 | POLB | DNA polymerase beta | Transferase | P06746 |
TCMT18 | GAA | Lysosomal alpha-glucosidase | Hydrolase | P10253 |
TCMT2 | MAPT | Microtubule-associated protein tau | Unclassified | P10636 |
TCMT3 | ALOX15 | Arachidonate 15-lipoxygenase | Oxidoreductase | P16050 |
TCMT33 | CYP3A4 | Cytochrome P450 3A4 | Oxidoreductase | P08684 |
TCMT6 | NFKB1 | Nuclear factor NF-kappa-B p105 subunit | Transcription factor | P19838 |
TCMT8 | KDM4E | Lysine-specific demethylase 4D-like | Oxidoreductase | B2RXH2 |
TCMT822 | FUT7 | Alpha-(1,3)-fucosyltransferase 7 | Transferase | Q11130 |
Target ID | Target Name |
---|---|
TCMT1108 | Integrase |
TCMT1465 | Entamoeba histolytica |
Ingredient ID: TCMC859
Formula: C5H12N4O3
Ingredient ID: TCMC7146
Formula: C19H22O6
Ingredient ID: TCMC7145
Formula: C19H22O7
Ingredient ID: TCMC7017
Formula: C17H18O6
Ingredient ID: TCMC6767
Formula: C30H32O15
Ingredient ID: TCMC673
Formula: C29H50O2
Ingredient ID: TCMC6616
Formula: C23H28O11
Ingredient ID: TCMC6479
Formula: C23H28O12
Ingredient ID: TCMC5778
Formula: C20H18O14
Ingredient ID: TCMC5667
Formula: C34H28O22
Ingredient ID: TCMC5427
Formula: C17H18O6
Ingredient ID: TCMC5375
Formula: C10H12O4
Ingredient ID: TCMC5311
Formula: C10H14O4
Ingredient ID: TCMC5281
Formula: C15H37N5
Ingredient ID: TCMC5258
Formula: C34H26O22
Ingredient ID: TCMC5238
Formula: C22H30O4
Ingredient ID: TCMC5012
Formula: C28H33O16
Ingredient ID: TCMC4900
Formula: C27H24O18
Ingredient ID: TCMC4827
Formula: C34H24O22
Ingredient ID: TCMC4417
Formula: C5H11NO3
Ingredient ID: TCMC4342
Formula: C22H28O5
Ingredient ID: TCMC4299
Formula: C21H28O3
Ingredient ID: TCMC4208
Formula: C21H34O10
Ingredient ID: TCMC3966
Formula: C29H50O
Ingredient ID: TCMC3961
Formula: C27H24O18
Ingredient ID: TCMC3934
Formula: C14H16O10
Ingredient ID: TCMC3610
Formula: C23H28O11
Ingredient ID: TCMC357
Formula: C5H12N4O3
Ingredient ID: TCMC3524
Formula: C15H30O2
Ingredient ID: TCMC3497
Formula: C17H18O6
Ingredient ID: TCMC3368
Formula: C23H28O12
Ingredient ID: TCMC3257
Formula: C41H28O26
Ingredient ID: TCMC3246
Formula: C23H28O11
Ingredient ID: TCMC3245
Formula: C27H22O18
Ingredient ID: TCMC3233
Formula: C35H60O6
Ingredient ID: TCMC2834
Formula: C7H6O2
Ingredient ID: TCMC2232
Formula: C29H50O2
Ingredient ID: TCMC1968
Formula: C4H12N2
Ingredient ID: TCMC1203
Formula: C8H8O5
Ingredient ID: TCMC1093
Formula: C27H46O2
Ingredient ID | Formulae | Name | MW | AlogP | MlogP | XlogP | # HBA | # HBD | PSA | # Rotatable Bond | # Ring | # Heacy Atom | Lipinski RO5 Violation |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
TCMC357 | C5H12N4O3 | 2-Amino-4-(Diaminomethylideneamino)Oxybutanoic Acid | 176.09 | -2.0468 | 1.24 | -3.019 | 5 | 5 | 134.45 | 9 | 0 | 12 | 0 |
TCMC673 | C29H50O2 | Alpha-Tochopherol | 430.38 | 3.2935 | 4.43 | 10.938 | 0 | 1 | 29.46 | 21 | 2 | 31 | 2 |
TCMC859 | C5H12N4O3 | Canavanine | 176.09 | -2.0468 | 1.24 | -3.019 | 5 | 5 | 134.45 | 9 | 0 | 12 | 0 |
TCMC1093 | C27H46O2 | E309 | 402.35 | 2.0095 | 4.21 | 10.714 | 0 | 1 | 29.46 | 19 | 2 | 29 | 2 |
TCMC1203 | C8H8O5 | Gallic Acid Methyl Ester | 184.04 | -1.3697 | 1.79 | 0.323 | 2 | 3 | 86.99 | 6 | 1 | 13 | 0 |
TCMC1968 | C4H12N2 | Putrescine | 88.1 | -2.0526 | 1.68 | -0.626 | 2 | 2 | 52.04 | 5 | 0 | 6 | 0 |
TCMC2232 | C29H50O2 | Vitamin E | 430.38 | 3.2935 | 4.43 | 10.938 | 0 | 1 | 29.46 | 21 | 2 | 31 | 2 |
TCMC2834 | C7H6O2 | Benzoic Acid | 121.0289544 | -0.9176 | 2.01 | 2.185 | 2 | 0 | 40.13 | 1 | 1 | 9 | 0 |
TCMC3233 | C35H60O6 | Alexandrin,Daucosterol,Eleutheroside A | 576.4389896 | -0.4469 | 4.65 | 10.487 | 6 | 4 | 99.38 | 9 | 5 | 41 | 1 |
TCMC3245 | C27H22O18 | Strictinin | 634.0806139 | -5.5485 | 2.45 | -1.35 | 9 | 11 | 310.66 | 3 | 5 | 45 | 1 |
TCMC3246 | C23H28O11 | Paeonioflorin | 480.1631617 | -3.3912 | 2.78 | 1.22 | 11 | 5 | 164.37 | 7 | 5 | 34 | 1 |
TCMC3257 | C41H28O26 | Casuarictin | 936.086881 | -7.5719 | 3.11 | -0.967 | 11 | 15 | 444.18 | 3 | 8 | 67 | 2 |
TCMC3368 | C23H28O12 | Oxypaeoniflorin | 496.1580763 | -3.8515 | 2.67 | -0.376 | 11 | 6 | 184.6 | 7 | 5 | 35 | 2 |
TCMC3497 | C17H18O6 | Paeoniflorigenone | 318.1103383 | -0.9654 | 2.67 | 2.159 | 6 | 1 | 82.06 | 4 | 4 | 23 | 0 |
TCMC3524 | C15H30O2 | 13-Methyl Tetradecanoic Acid | 241.2167552 | -2.6463 | 2.89 | 6.459 | 2 | 0 | 40.13 | 12 | 0 | 17 | 2 |
TCMC3610 | C23H28O11 | Albiflorin | 480.1631617 | -3.3767 | 2.78 | 0.81 | 11 | 5 | 172.21 | 7 | 4 | 34 | 1 |
TCMC3934 | C14H16O10 | 3-O-Galloyl Quinic Acid | 343.0665217 | -3.6954 | 1.9 | -2.067 | 7 | 6 | 187.81 | 4 | 2 | 24 | 1 |
TCMC3961 | C27H24O18 | 1,3,6-Trigalloyl-Β-D-Glucose | 636.0962639 | -5.5485 | 2.45 | -0.947 | 9 | 11 | 310.66 | 10 | 4 | 45 | 1 |
TCMC3966 | C29H50O | Sitosterol,Β-Sitosterol | 414.3861662 | 1.3 | 4.54 | 11.595 | 1 | 1 | 20.23 | 6 | 4 | 30 | 1 |
TCMC4208 | C21H34O10 | Z-1S,5R-Β-Pinen-10-Yl-Β-Vicianoside | 446.2151973 | -2.6697 | 2.67 | 0.415 | 10 | 6 | 158.3 | 4 | 3 | 31 | 1 |
TCMC4299 | C21H28O3 | Pyrethrin I | 328.2038448 | 4.0394 | 3.44 | 4.408 | 3 | 0 | 43.37 | 7 | 2 | 24 | 0 |
TCMC4342 | C22H28O5 | Pyrethrin Ii | 372.193674 | 3.4086 | 3.33 | 3.274 | 5 | 0 | 69.67 | 9 | 2 | 27 | 0 |
TCMC4417 | C5H11NO3 | L-Α-Amino-Δ-Hydroxyvaleric Acid | 133.0738932 | -3.5433 | 1.57 | -1.021 | 3 | 2 | 88 | 4 | 0 | 9 | 0 |
TCMC4827 | C34H24O22 | Pedunculagin | 784.0759224 | -6.5602 | 2.78 | -1.789 | 10 | 13 | 377.42 | 0 | 7 | 56 | 1 |
TCMC4900 | C27H24O18 | 1,2,3-Tri-O-Galloyl-Β-D-Glucose | 636.0962639 | -5.5485 | 2.45 | -0.518 | 9 | 11 | 310.66 | 10 | 4 | 45 | 1 |
TCMC5012 | C28H33O16 | Peonin | 625.17686 | -5.5016 | 2.78 | -0.632 | 10 | 10 | 248.45 | 8 | 5 | 44 | 1 |
TCMC5238 | C22H30O4 | Palbinone | 358.2144094 | 0.8294 | 3.44 | 4.827 | 4 | 2 | 74.6 | 0 | 4 | 26 | 0 |
TCMC5258 | C34H26O22 | Tellimagrandin I | 786.0915725 | -6.5602 | 2.78 | -0.957 | 10 | 13 | 377.42 | 6 | 6 | 56 | 1 |
TCMC5281 | C15H37N5 | Aminobutyl Canavalmine | 292.3440213 | -9.1427 | 2.56 | 1.41 | 0 | 5 | 105.11 | 17 | 0 | 20 | 1 |
TCMC5311 | C10H14O4 | Paeonilactone A | 198.0892089 | -0.4319 | 2.12 | -0.019 | 4 | 1 | 63.6 | 0 | 2 | 14 | 0 |
TCMC5375 | C10H12O4 | Paeonilactone B | 196.0735589 | -0.2148 | 2.12 | -0.201 | 4 | 1 | 63.6 | 0 | 2 | 14 | 0 |
TCMC5427 | C17H18O6 | Paeonilactone C | 318.1103383 | -0.9509 | 2.67 | 2.335 | 6 | 1 | 89.9 | 4 | 3 | 23 | 0 |
TCMC5667 | C34H28O22 | 1,2,4,6-Tetra-O-Galloyl-Β-D-Glucose | 788.1072225 | -6.5602 | 2.78 | -0.125 | 10 | 13 | 377.42 | 13 | 5 | 56 | 2 |
TCMC5778 | C20H18O14 | 2,3-O-(S)-Hexahydroxydiphenoyl-D-Glucopyranose | 482.0696553 | -4.5368 | 2.12 | -2.172 | 8 | 9 | 243.9 | 1 | 4 | 34 | 1 |
TCMC6479 | C23H28O12 | Oxypaeoniflorin | 496.1580763 | -3.8515 | 2.67 | -0.376 | 11 | 6 | 184.6 | 7 | 5 | 35 | 2 |
TCMC6616 | C23H28O11 | Albiflorin | 480.1631617 | -3.3767 | 2.78 | 0.81 | 11 | 5 | 172.21 | 7 | 4 | 34 | 1 |
TCMC6767 | C30H32O15 | Galloylpaeoniflorin | 632.1741203 | -4.4029 | 3.11 | 1.613 | 12 | 7 | 231.13 | 10 | 6 | 45 | 2 |
TCMC7017 | C17H18O6 | Paeoniflorigenone | 318.1103383 | -0.9654 | 2.67 | 2.159 | 6 | 1 | 82.06 | 4 | 4 | 23 | 0 |
TCMC7145 | C19H22O7 | Canavalia Gibberellin I | 360.120903 | -2.1754 | 2.78 | -0.858 | 7 | 1 | 126.79 | 2 | 5 | 26 | 0 |
TCMC7146 | C19H22O6 | Canavalia Gibberellin Ii | 345.1338134 | -1.2063 | 2.89 | -0.355 | 6 | 2 | 106.89 | 2 | 5 | 25 | 0 |