Component ID |
TCMH907 |
Latin Name |
Piper nigrum |
English Name |
Black pepper |
Chinese Pinyin Name |
Hu Jiao |
中文名 |
胡椒 |
TCM Properties |
Hot,Pungent |
TCM Meridians |
Large Intestine,Stomach |
Therapeutic Class English |
For warming interior |
Therapeutic Class Chinese |
温里 |
Functions |
dispel cold from the stomach, and eliminate phlegm |
Toxicity |
NA |
Geo-authentic habitats (道地产区) |
Guangdong Province,Hong Kong,Macao |
Reference |
Chinese Pharmacopoeia (2015) |
Barcode ID |
ITSAA3189-14 |
Barcode Source |
BOLDSYSTEMS |
Prescription ID | Prescription English Name | Prescription Chinese Name |
---|---|---|
TCMF3234 | Bao Zhen Ointment | 宝珍膏 |
TCMFx3418 | Die Da Wan Hua You | 跌打万花油 |
TCMF3375 | Feng Shi Gao Yao | 风湿膏药 |
TCMF3540 | Fu Fang Ge Qing Tablets | 复方蛤青片 |
TCMF3547 | Fu Fang Ge Qing Zhu She Oral Liquid | 复方蛤青注射液 |
TCMF3502 | Gan Lu Ointment | 甘露膏 |
TCMFx4187 | Hai Yang Wei Yao | 海洋胃药 |
TCMFx4445 | Huo Xue Zhi Tong Ointment | 活血止痛膏 |
TCMFx7032 | Long Hu Ren Dan | 龙虎人丹 |
TCMFx642 | Pa Zhu Pills | 帕朱丸 |
TCMFx226 | Qi Wei Ke Teng Zi Pills | 七味榼藤子丸 |
TCMFx5006 | Qing Yu Bi Wen Dan | 庆余辟瘟丹 |
TCMFx490 | Qing Yu Pi Wen Dan | 庆余辟瘟丹 |
TCMFx1986 | Qiwei Ketengzi Pills | 七味榼藤子丸 |
TCMFx5694 | Shang Ke Wan Hua You | 伤科万花油 |
TCMF5719 | Shang Shi Bao Zhen Ointment | 伤湿宝珍膏 |
TCMF978 | Tong Luo Qu Tong Ointment | 通络祛痛膏 |
TCMF5586 | Wei Chang Ling Capsules | 胃肠灵胶囊 |
TCMF5650 | Wei Huo Ling Tablets | 胃活灵片 |
TCMFx5802 | Wei Tong Ding | 胃痛定 |
TCMFx5826 | Wei Tong Powder | 胃痛散 |
TCMF6172 | Xiao Er Nuan Qi Ointment | 小儿暖脐膏 |
Target ID | Gene Symbol | Target Name | Target Class | Uniprot ID |
---|---|---|---|---|
TCMT1 | EHMT2 | Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 | Transferase | Q96KQ7 |
TCMT114 | CNR2 | Cannabinoid CB2 receptor | GPCR | P34972 |
TCMT125 | GBA | Beta-glucocerebrosidase | Hydrolase | P04062 |
TCMT126 | TERT | Telomerase reverse transcriptase | Transferase | O14746 |
TCMT150 | RORC | Nuclear receptor ROR-gamma | Nuclear receptor | P51449 |
TCMT156 | CYP19A1 | Cytochrome P450 19A1 | Oxidoreductase | P11511 |
TCMT162 | UGT1A1 | UDP-glucuronosyltransferase 1-1 | Transferase | P22309 |
TCMT164 | PTGS1 | Cyclooxygenase-1 | Oxidoreductase | P23219 |
TCMT176 | SOAT1 | Acyl coenzyme A:cholesterol acyltransferase 1 | Transferase | P35610 |
TCMT18 | GAA | Lysosomal alpha-glucosidase | Hydrolase | P10253 |
TCMT187 | AR | Androgen Receptor | Nuclear receptor | P10275 |
TCMT189 | DUSP3 | Dual specificity protein phosphatase 3 | Hydrolase | P51452 |
TCMT191 | STAT3 | Signal transducer and activator of transcription 3 | Transcription factor | P40763 |
TCMT2 | MAPT | Microtubule-associated protein tau | Unclassified | P10636 |
TCMT206 | CYP2A6 | Cytochrome P450 2A6 | Oxidoreductase | P11509 |
TCMT213 | SLC22A1 | Solute carrier family 22 member 1 | Transporter | O15245 |
TCMT217 | CYP2C8 | Cytochrome P450 2C8 | Oxidoreductase | P10632 |
TCMT218 | CYP2B6 | Cytochrome P450 2B6 | Oxidoreductase | P20813 |
TCMT219 | CYP1A2 | Cytochrome P450 1A2 | Oxidoreductase | P05177 |
TCMT220 | CYP2J2 | Cytochrome P450 2J2 | Oxidoreductase | P51589 |
TCMT232 | ABCB1 | P-glycoprotein 1 | Transporter | P08183 |
TCMT241 | CHRNA7 | Neuronal acetylcholine receptor protein alpha-7 subunit | Ion channel | P36544 |
TCMT248 | CXCL8 | Interleukin-8 | Unclassified | P10145 |
TCMT268 | CYP2A13 | Cytochrome P450 2A13 | Oxidoreductase | Q16696 |
TCMT27 | DRD1 | Dopamine D1 receptor | GPCR | P21728 |
TCMT276 | SLCO2B1 | Solute carrier organic anion transporter family member 2B1 | Transporter | O94956 |
TCMT277 | SLCO1B3 | Solute carrier organic anion transporter family member 1B3 | Transporter | Q9NPD5 |
TCMT278 | SLCO1B1 | Solute carrier organic anion transporter family member 1B1 | Transporter | Q9Y6L6 |
TCMT297 | FABP4 | Fatty acid binding protein adipocyte | Unclassified | P15090 |
TCMT298 | FABP3 | Fatty acid binding protein muscle | Hydrolase | P05413 |
TCMT3 | ALOX15 | Arachidonate 15-lipoxygenase | Oxidoreductase | P16050 |
TCMT30 | PTGS2 | Cyclooxygenase-2 | Oxidoreductase | P35354 |
TCMT307 | KCNH2 | HERG | Ion channel | Q12809 |
TCMT31 | CYP2C19 | Cytochrome P450 2C19 | Oxidoreductase | P33261 |
TCMT314 | HTR2C | Serotonin 2c (5-HT2c) receptor | GPCR | P28335 |
TCMT327 | TRPV1 | Vanilloid receptor | Ion channel | Q8NER1 |
TCMT33 | CYP3A4 | Cytochrome P450 3A4 | Oxidoreductase | P08684 |
TCMT34 | CYP2D6 | Cytochrome P450 2D6 | Oxidoreductase | P10635 |
TCMT341 | NR1I2 | Pregnane X receptor | Nuclear receptor | O75469 |
TCMT42 | KMT2A | Histone-lysine N-methyltransferase MLL | Transferase | Q03164 |
TCMT46 | F3 | Coagulation factor III | Unclassified | P13726 |
TCMT48 | SCN5A | Sodium channel protein type V alpha subunit | Ion channel | Q14524 |
TCMT552 | CHRNA3 | Neuronal acetylcholine receptor subunit alpha-3 | Ion channel | P32297 |
TCMT555 | HDAC6 | Histone deacetylase 6 | Hydrolase | Q9UBN7 |
TCMT557 | HDAC1 | Histone deacetylase 1 | Hydrolase | Q13547 |
TCMT559 | ADRB2 | Beta-2 adrenergic receptor | GPCR | P07550 |
TCMT6 | NFKB1 | Nuclear factor NF-kappa-B p105 subunit | Transcription factor | P19838 |
TCMT629 | ABCC1 | Multidrug resistance-associated protein 1 | Transporter | P33527 |
TCMT63 | PPARA | Peroxisome proliferator-activated receptor alpha | Nuclear receptor | Q07869 |
TCMT633 | SLC6A4 | Serotonin transporter | Transporter | P31645 |
TCMT634 | SLC6A2 | Norepinephrine transporter | Transporter | P23975 |
TCMT635 | SLC6A3 | Dopamine transporter | Transporter | Q01959 |
TCMT64 | PPARD | Peroxisome proliferator-activated receptor delta | Nuclear receptor | Q03181 |
TCMT640 | CTSD | Cathepsin D | Unclassified | P07339 |
TCMT642 | ADRA1D | Alpha-1d adrenergic receptor | GPCR | P25100 |
TCMT643 | ADRA1A | Alpha-1a adrenergic receptor | GPCR | P35348 |
TCMT650 | ADRA1B | Alpha-1b adrenergic receptor | GPCR | P35368 |
TCMT67 | PPARG | Peroxisome proliferator-activated receptor gamma | Nuclear receptor | P37231 |
TCMT675 | ADRB1 | Beta-1 adrenergic receptor | GPCR | P08588 |
TCMT690 | HDAC3 | Histone deacetylase 3 | Hydrolase | O15379 |
TCMT725 | CACNA1C | Voltage-gated L-type calcium channel alpha-1C subunit | Ion channel | Q13936 |
TCMT747 | ABCG2 | ATP-binding cassette sub-family G member 2 | Transporter | Q9UNQ0 |
TCMT8 | KDM4E | Lysine-specific demethylase 4D-like | Oxidoreductase | B2RXH2 |
TCMT80 | MAPK1 | MAP kinase ERK2 | Kinase | P28482 |
TCMT808 | FABP5 | Fatty acid binding protein epidermal | Unclassified | Q01469 |
TCMT809 | FABP2 | Fatty acid binding protein intestinal | Unclassified | P12104 |
TCMT810 | TLR2 | Toll-like receptor 2 | Unclassified | O60603 |
TCMT82 | ESR1 | Estrogen receptor alpha | Nuclear receptor | P03372 |
TCMT87 | CYP2C9 | Cytochrome P450 2C9 | Oxidoreductase | P11712 |
Target ID | Target Name |
---|---|
TCMT1112 | Quinolone resistance protein norA |
TCMT1181 | Mycobacterium tuberculosis H37Ra |
TCMT1218 | Staphylococcus aureus |
TCMT1226 | Klebsiella pneumoniae |
TCMT1232 | Pseudomonas aeruginosa |
TCMT1246 | Escherichia coli |
TCMT1251 | Candida albicans |
TCMT1253 | Penicillium chrysogenum |
TCMT1289 | Shigella dysenteriae |
TCMT1361 | Neisseria meningitidis |
TCMT1382 | Plasmodium falciparum (isolate K1 / Thailand) |
TCMT1393 | Vibrio sp. |
TCMT1438 | Plasmodium falciparum |
TCMT1442 | Leishmania donovani |
TCMT1454 | Bacillus subtilis |
TCMT1455 | Mycobacterium tuberculosis H37Rv |
TCMT1462 | Streptococcus mutans |
TCMT1463 | Mycobacterium tuberculosis |
Ingredient ID: TCMC793
Formula: C15H26O
Ingredient ID: TCMC7118
Formula: C16H27NO4
Ingredient ID: TCMC7117
Formula: C16H25NO4
Ingredient ID: TCMC7116
Formula: C16H25NO4
Ingredient ID: TCMC7059
Formula: C16H14O3
Ingredient ID: TCMC7058
Formula: C17H16O4
Ingredient ID: TCMC7057
Formula: C19H18O3
Ingredient ID: TCMC7
Formula: C20H20O6
Ingredient ID: TCMC6961
Formula: C15H24
Ingredient ID: TCMC6912
Formula: C16H27NO4
Ingredient ID: TCMC6909
Formula: C16H27NO4
Ingredient ID: TCMC677
Formula: C15H23NO2
Ingredient ID: TCMC671
Formula: C10H16
Ingredient ID: TCMC6700
Formula: C25H33NO3
Ingredient ID: TCMC6699
Formula: C14H15NO2
Ingredient ID: TCMC6698
Formula: C23H31NO3
Ingredient ID: TCMC668
Formula: C15H26O
Ingredient ID: TCMC6624
Formula: C22H39NO
Ingredient ID: TCMC6404
Formula: C20H27NO3
Ingredient ID: TCMC64
Formula: C15H23NO2
Ingredient ID: TCMC6247
Formula: C16H17NO5
Ingredient ID: TCMC6246
Formula: C16H17NO5
Ingredient ID: TCMC6216
Formula: C21H20O7
Ingredient ID: TCMC5869
Formula: C16H19NO3
Ingredient ID: TCMC5794
Formula: C18H19NO3
Ingredient ID: TCMC5710
Formula: C16H17NO3
Ingredient ID: TCMC5702
Formula: C12H23NO3
Ingredient ID: TCMC5700
Formula: C10H16O
Ingredient ID: TCMC5694
Formula: C16H19NO4
Ingredient ID: TCMC5668
Formula: C15H23NO2
Ingredient ID: TCMC5662
Formula: C18H18O2
Ingredient ID: TCMC5637
Formula: C24H33NO3
Ingredient ID: TCMC5636
Formula: C24H43NO
Ingredient ID: TCMC5623
Formula: C15H27NO3
Ingredient ID: TCMC5609
Formula: C15H27NO3
Ingredient ID: TCMC5606
Formula: C19H25NO3
Ingredient ID: TCMC5598
Formula: C15H25NO
Ingredient ID: TCMC5582
Formula: C23H28O7
Ingredient ID: TCMC5559
Formula: C16H27NO
Ingredient ID: TCMC5547
Formula: C15H27NO
Ingredient ID: TCMC5544
Formula: C18H23NO3
Ingredient ID: TCMC5359
Formula: C24H43NO
Ingredient ID: TCMC5337
Formula: C19H21NO3
Ingredient ID: TCMC5272
Formula: C21H27NO3
Ingredient ID: TCMC5271
Formula: C22H41NO
Ingredient ID: TCMC5268
Formula: C15H19NO3
Ingredient ID: TCMC5261
Formula: C19H28O2
Ingredient ID: TCMC5260
Formula: C13H12O4
Ingredient ID: TCMC5152
Formula: C12H21NO
Ingredient ID: TCMC4717
Formula: C10H16O
Ingredient ID: TCMC4716
Formula: C10H16O
Ingredient ID: TCMC4437
Formula: C20H20O6
Ingredient ID: TCMC4276
Formula: C18H16O6
Ingredient ID: TCMC4218
Formula: C16H11NO3
Ingredient ID: TCMC4170
Formula: C17H19NO3
Ingredient ID: TCMC4169
Formula: C17H19NO3
Ingredient ID: TCMC4150
Formula: C13H15NO
Ingredient ID: TCMC4149
Formula: C14H17NO
Ingredient ID: TCMC4144
Formula: C14H15NO3
Ingredient ID: TCMC4131
Formula: C16H17NO3
Ingredient ID: TCMC4123
Formula: C9H14O
Ingredient ID: TCMC4118
Formula: C22H24O7
Ingredient ID: TCMC4114
Formula: C15H17NO3
Ingredient ID: TCMC4071
Formula: C16H17NO3
Ingredient ID: TCMC3928
Formula: C24H32O7
Ingredient ID: TCMC3598
Formula: C21H26NO4
Ingredient ID: TCMC3436
Formula: C10H18O
Ingredient ID: TCMC3400
Formula: C10H16O
Ingredient ID: TCMC34
Formula: C10H14N2
Ingredient ID: TCMC3302
Formula: C10H16O
Ingredient ID: TCMC304
Formula: C10H18O
Ingredient ID: TCMC284
Formula: C10H16
Ingredient ID: TCMC2822
Formula: C15H24
Ingredient ID: TCMC2650
Formula: C12H14O4
Ingredient ID: TCMC2597
Formula: C14H23NO
Ingredient ID: TCMC2550
Formula: C15H24
Ingredient ID: TCMC2541
Formula: C10H18O
Ingredient ID: TCMC2539
Formula: C10H16
Ingredient ID: TCMC2510
Formula: C15H26O
Ingredient ID: TCMC2484
Formula: C10H18O
Ingredient ID: TCMC2366
Formula: C15H24O
Ingredient ID: TCMC2324
Formula: C10H16
Ingredient ID: TCMC2226
Formula: C27H38N2O4
Ingredient ID: TCMC2122
Formula: C20H28N2O5S
Ingredient ID: TCMC2105
Formula: C18H36O2
Ingredient ID: TCMC2075
Formula: C15H17NO3
Ingredient ID: TCMC2073
Formula: C14H15NO4
Ingredient ID: TCMC2072
Formula: C15H19NO3
Ingredient ID: TCMC2071
Formula: C13H15NO2S
Ingredient ID: TCMC2019
Formula: C10H14N2
Ingredient ID: TCMC2009
Formula: C22H29NO3
Ingredient ID: TCMC2008
Formula: C20H25NO3
Ingredient ID: TCMC1909
Formula: C17H19NO5
Ingredient ID: TCMC1908
Formula: C21H29NO3
Ingredient ID: TCMC1906
Formula: C8H6O3
Ingredient ID: TCMC1905
Formula: C16H19NO3
Ingredient ID: TCMC1904
Formula: C17H19NO3
Ingredient ID: TCMC1902
Formula: C17H21NO3
Ingredient ID: TCMC1848
Formula: C14H25NO
Ingredient ID: TCMC1830
Formula: C16H32O2
Ingredient ID: TCMC1788
Formula: C18H34O2
Ingredient ID: TCMC176
Formula: C27H38N2O4
Ingredient ID: TCMC1745
Formula: C16H29NO
Ingredient ID: TCMC1743
Formula: C10H14N2
Ingredient ID: TCMC1738
Formula: C15H26O
Ingredient ID: TCMC1712
Formula: C15H24O
Ingredient ID: TCMC168
Formula: C27H38N2O4
Ingredient ID: TCMC1671
Formula: C14H17NO3.ClH
Ingredient ID: TCMC1662
Formula: C14H18N2
Ingredient ID: TCMC166
Formula: C15H12O4
Ingredient ID: TCMC1608
Formula: C10H16
Ingredient ID: TCMC1496
Formula: C18H30O2
Ingredient ID: TCMC1495
Formula: C18H32O2
Ingredient ID: TCMC1493
Formula: C10H18O
Ingredient ID: TCMC1492
Formula: C10H18O
Ingredient ID: TCMC1299
Formula: C24H33NO3
Ingredient ID: TCMC1159
Formula: C10H12O2
Ingredient ID: TCMC100
Formula: C17H19NO3
Ingredient ID | Formulae | Name | MW | AlogP | MlogP | XlogP | # HBA | # HBD | PSA | # Rotatable Bond | # Ring | # Heacy Atom | Lipinski RO5 Violation |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
TCMC7 | C20H20O6 | (-)-Cubebin | 356.13 | -1.0458 | 3 | 3.083 | 2 | 1 | 66.38 | 5 | 5 | 26 | 0 |
TCMC34 | C10H14N2 | (+/-)Nicotine | 162.12 | -0.4993 | 2.34 | 1.485 | 2 | 0 | 16.13 | 2 | 2 | 12 | 0 |
TCMC64 | C15H23NO2 | (2R)-1-(Propan-2-Ylamino)-3-(2-Prop-2-Enylphenoxy)Propan-2-Ol | 249.17 | 0.0189 | 2.78 | 3.272 | 2 | 2 | 41.49 | 11 | 1 | 18 | 0 |
TCMC100 | C17H19NO3 | (2Z,4Z)-5-(1,3-Benzodioxol-5-Yl)-1-Piperidin-1-Ylpenta-2,4-Dien-1-One | 285.14 | -0.9494 | 2.89 | 3.167 | 2 | 0 | 38.77 | 4 | 3 | 21 | 0 |
TCMC166 | C15H12O4 | (R)-Pinocembrin | 256.07 | -1.3541 | 2.67 | 2.493 | 1 | 2 | 66.76 | 3 | 3 | 19 | 0 |
TCMC168 | C27H38N2O4 | (R)-Verapamil | 454.28 | 0.1993 | 3.77 | 4.71 | 2 | 0 | 63.95 | 20 | 2 | 33 | 1 |
TCMC176 | C27H38N2O4 | (S)-Verapamil | 454.28 | 0.1993 | 3.77 | 4.71 | 2 | 0 | 63.95 | 20 | 2 | 33 | 1 |
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 |
TCMC304 | C10H18O | 2-(4-Methylcyclohex-3-En-1-Yl)Propan-2-Ol | 154.14 | 1.1223 | 2.45 | 2.369 | 1 | 1 | 20.23 | 5 | 1 | 11 | 0 |
TCMC668 | C15H26O | Alpha-Bisabolol | 222.2 | 2.7502 | 3 | 4.085 | 1 | 1 | 20.23 | 9 | 1 | 16 | 0 |
TCMC671 | C10H16 | Alpha-Pinene | 136.13 | 1.5162 | 2.56 | 4.177 | 0 | 0 | 0 | 3 | 1 | 10 | 0 |
TCMC677 | C15H23NO2 | Alprenolol | 249.17 | 0.0189 | 2.78 | 3.272 | 2 | 2 | 41.49 | 11 | 1 | 18 | 0 |
TCMC793 | C15H26O | Beta-Caryophyllene Alcohol | 222.2 | 1.0912 | 3 | 5.026 | 1 | 1 | 20.23 | 4 | 3 | 16 | 1 |
TCMC1159 | C10H12O2 | Eugenol | 164.08 | 0.5166 | 2.34 | 2.484 | 0 | 1 | 29.46 | 5 | 1 | 12 | 0 |
TCMC1299 | C24H33NO3 | Guineensine | 383.25 | 0.6319 | 3.66 | 7.693 | 2 | 1 | 51.05 | 15 | 2 | 28 | 2 |
TCMC1492 | C10H18O | Linalool | 154.14 | 2.4692 | 2.45 | 2.468 | 1 | 1 | 20.23 | 8 | 0 | 11 | 0 |
TCMC1493 | C10H18O | Linalool (+) | 154.14 | 2.4692 | 2.45 | 2.468 | 1 | 1 | 20.23 | 8 | 0 | 11 | 0 |
TCMC1495 | C18H32O2 | Linoleic Acid | 280.24 | -0.9485 | 3.22 | 7.865 | 2 | 1 | 37.3 | 16 | 0 | 20 | 2 |
TCMC1496 | C18H30O2 | Linolenic Acid | 278.22 | -0.0979 | 3.22 | 7.538 | 2 | 1 | 37.3 | 15 | 0 | 20 | 2 |
TCMC1608 | C10H16 | Myrcene | 136.13 | 3.0936 | 2.56 | 4.17 | 0 | 0 | 0 | 6 | 0 | 10 | 0 |
TCMC1662 | C14H18N2 | 214.15 | -1.0493 | 2.78 | 2.311 | 2 | 1 | 15.27 | 0 | 4 | 16 | 0 | |
TCMC1671 | C14H17NO3.ClH | 247.12 | -1.5959 | 2.56 | 1.726 | 2 | 0 | 38.77 | 3 | 3 | 18 | 0 | |
TCMC1712 | C15H24O | 220.18 | 1.9144 | 3 | 4.607 | 1 | 0 | 12.53 | 3 | 3 | 16 | 0 | |
TCMC1738 | C15H26O | Nerolidol | 222.2 | 3.7014 | 3 | 4.29 | 1 | 1 | 20.23 | 12 | 0 | 16 | 0 |
TCMC1743 | C10H14N2 | Nicotine | 162.12 | -0.4993 | 2.34 | 1.485 | 2 | 0 | 16.13 | 2 | 2 | 12 | 0 |
TCMC1745 | C16H29NO | N-Isobutyl-(2E,4E)-Dodecadienamide | 251.22 | -0.0255 | 3 | 6.025 | 2 | 1 | 32.59 | 14 | 0 | 18 | 1 |
TCMC1788 | C18H34O2 | Oleic Acid | 282.26 | -2.3427 | 3.22 | 8.192 | 2 | 1 | 37.3 | 17 | 0 | 20 | 2 |
TCMC1830 | C16H32O2 | Palmitic Acid | 256.24 | -3.8977 | 3 | 7.57 | 2 | 1 | 37.3 | 16 | 0 | 18 | 2 |
TCMC1848 | C14H25NO | Pellitorin | 223.19 | 0.5505 | 2.78 | 4.887 | 2 | 1 | 32.59 | 12 | 0 | 16 | 0 |
TCMC1902 | C17H21NO3 | Piperanine | 287.15 | -1.0992 | 2.89 | 3.245 | 2 | 0 | 38.77 | 5 | 3 | 21 | 0 |
TCMC1904 | C17H19NO3 | Piperine | 285.14 | -0.9494 | 2.89 | 3.167 | 2 | 0 | 38.77 | 4 | 3 | 21 | 0 |
TCMC1905 | C16H19NO3 | Piperlonguminine | 273.14 | 0.8049 | 2.78 | 3.657 | 2 | 1 | 51.05 | 8 | 2 | 20 | 0 |
TCMC1906 | C8H6O3 | Piperonal | 150.03 | -0.4951 | 2.01 | 1.486 | 1 | 0 | 35.53 | 1 | 2 | 11 | 0 |
TCMC1908 | C21H29NO3 | Piperrolein B | 343.21 | -2.1721 | 3.33 | 5.482 | 2 | 0 | 38.77 | 9 | 3 | 25 | 1 |
TCMC1909 | C17H19NO5 | Piplartine | 317.13 | -0.4679 | 2.67 | 1.333 | 3 | 0 | 65.07 | 9 | 2 | 23 | 0 |
TCMC2008 | C20H25NO3 | Retrofractamide A | 327.18 | 1.7839 | 3.22 | 5.417 | 2 | 1 | 51.05 | 11 | 2 | 24 | 1 |
TCMC2009 | C22H29NO3 | Retrofractamide B | 355.21 | 1.2079 | 3.44 | 6.555 | 2 | 1 | 51.05 | 13 | 2 | 26 | 1 |
TCMC2019 | C10H14N2 | R-Nicotine | 162.12 | -0.4993 | 2.34 | 1.485 | 2 | 0 | 16.13 | 2 | 2 | 12 | 0 |
TCMC2071 | C13H15NO2S | Sid14730841 | 249.08 | -0.8792 | 2.45 | 2.922 | 1 | 0 | 53.79 | 2 | 3 | 17 | 0 |
TCMC2072 | C15H19NO3 | Sid14737105 | 261.14 | -1.3477 | 2.67 | 1.884 | 2 | 0 | 38.77 | 4 | 3 | 19 | 0 |
TCMC2073 | C14H15NO4 | Sid17403365 | 261.1 | -0.6841 | 2.45 | 1.209 | 3 | 0 | 48 | 3 | 3 | 19 | 0 |
TCMC2075 | C15H17NO3 | Sid47200685 | 259.12 | -1.3377 | 2.67 | 3.21 | 2 | 1 | 51.05 | 4 | 3 | 19 | 0 |
TCMC2105 | C18H36O2 | Stearic Acid | 284.27 | -4.4737 | 3.22 | 8.708 | 2 | 1 | 37.3 | 18 | 0 | 20 | 2 |
TCMC2122 | C20H28N2O5S | Tamsulosin | 408.17 | -1.2777 | 2.78 | 2.678 | 4 | 2 | 108.26 | 15 | 2 | 28 | 1 |
TCMC2226 | C27H38N2O4 | Verapamil | 454.28 | 0.1993 | 3.77 | 4.71 | 2 | 0 | 63.95 | 20 | 2 | 33 | 1 |
TCMC2324 | C10H16 | Limonene | 136.13 | 2.1424 | 2.56 | 3.729 | 0 | 0 | 0 | 3 | 1 | 10 | 0 |
TCMC2366 | C15H24O | 220.18 | 1.9144 | 3 | 4.607 | 1 | 0 | 12.53 | 3 | 3 | 16 | 0 | |
TCMC2484 | C10H18O | Terpineol | 154.14 | 1.1223 | 2.45 | 1.947 | 1 | 1 | 20.23 | 5 | 1 | 11 | 0 |
TCMC2510 | C15H26O | Nerolidiol | 222.2 | 3.7014 | 3 | 4.29 | 1 | 1 | 20.23 | 12 | 0 | 16 | 0 |
TCMC2539 | C10H16 | Gamma-Terpinene | 136.13 | 2.4017 | 2.56 | 3.852 | 0 | 0 | 0 | 4 | 1 | 10 | 0 |
TCMC2541 | C10H18O | Alpha-Terpineol | 154.14 | 1.1223 | 2.45 | 2.369 | 1 | 1 | 20.23 | 5 | 1 | 11 | 0 |
TCMC2550 | C15H24 | (+)-Germacrene D | 204.19 | 2.7967 | 3.11 | 6.294 | 0 | 0 | 0 | 4 | 1 | 15 | 1 |
TCMC2597 | C14H23NO | Sarmentine | 221.18 | -0.9158 | 2.78 | 4.039 | 2 | 0 | 20.31 | 8 | 1 | 16 | 0 |
TCMC2650 | C12H14O4 | Dillapiole | 222.09 | 0.6224 | 2.34 | 1.831 | 0 | 0 | 36.92 | 6 | 2 | 16 | 0 |
TCMC2822 | C15H24 | Alpha-Humulone | 204.19 | 4.1708 | 3.11 | 5.94 | 0 | 0 | 0 | 4 | 1 | 15 | 1 |
TCMC3302 | C10H16O | Trans-Pinocarveol | 152.1201151 | 0.7964 | 2.45 | 2.192 | 1 | 1 | 20.23 | 0 | 1 | 11 | 0 |
TCMC3400 | C10H16O | Piperitone | 152.1201151 | 1.2899 | 2.45 | 2.238 | 1 | 0 | 17.07 | 1 | 1 | 11 | 0 |
TCMC3436 | C10H18O | Cis-P-2-Menthen-1-Ol | 154.1357652 | 0.9401 | 2.45 | 2.77 | 1 | 1 | 20.23 | 1 | 1 | 11 | 0 |
TCMC3598 | C21H26NO4 | Menisperine | 356.1861833 | -1.5758 | 3.22 | 1.527 | 0 | 1 | 47.92 | 3 | 4 | 26 | 0 |
TCMC3928 | C24H32O7 | Grandisin | 432.2148034 | -0.2989 | 3.33 | 3.08 | 1 | 0 | 64.61 | 8 | 3 | 31 | 0 |
TCMC4071 | C16H17NO3 | 1-[1-Oxo-5(3,4-Methylenedioxyphenyl)-2E,4E-Pentadienyl]Pyrrolidine | 271.1208434 | -0.6614 | 2.78 | 2.809 | 2 | 0 | 38.77 | 4 | 3 | 20 | 0 |
TCMC4114 | C15H17NO3 | 1-[1-Oxo-3(3,4-Methylenedioxyphenyl)-2E-Propenyl]Piperidine | 259.1208434 | -1.4172 | 2.67 | 2.473 | 2 | 0 | 38.77 | 3 | 3 | 19 | 0 |
TCMC4118 | C22H24O7 | Rel-(7R,8R,7'R,8'R)-3,4,3',4'-Dimethylenedioxy-5,5'-Dimethoxy-7,7'-Epoxylignan | 400.1522031 | -0.6971 | 3.11 | 2.934 | 1 | 0 | 64.61 | 4 | 5 | 29 | 0 |
TCMC4123 | C9H14O | Cryptone | 138.1044651 | 0.6545 | 2.34 | 2.387 | 1 | 0 | 17.07 | 1 | 1 | 10 | 0 |
TCMC4131 | C16H17NO3 | 1-[1-Oxo-5(3,4-Methylenedioxyphenyl)-2E,4Z-Pentadienyl] Pyrrolidine | 271.1208434 | -0.6614 | 2.78 | 2.809 | 2 | 0 | 38.77 | 4 | 3 | 20 | 0 |
TCMC4144 | C14H15NO3 | 1-[1-Oxo-3(3,4-Methylenedioxyphenyl)-2E-Propenyl]Pyrrolidine | 245.1051933 | -1.1292 | 2.56 | 2.115 | 2 | 0 | 38.77 | 3 | 3 | 18 | 0 |
TCMC4149 | C14H17NO | 1-(1-Oxo-3-Phenyl-2E-Propenyl)Piperidine | 215.1310142 | -1.1145 | 2.78 | 4.7 | 2 | 0 | 20.31 | 3 | 2 | 16 | 0 |
TCMC4150 | C13H15NO | (1-Oxo-3-Phenyl-2E-Propenyl)Pyrrolidine | 201.1153641 | -0.8265 | 2.67 | 4.342 | 2 | 0 | 20.31 | 3 | 2 | 15 | 0 |
TCMC4169 | C17H19NO3 | 1-[1-Oxo-5(3,4-Methylenedioxyphenyl)-2Z,4E-Pentadienyl] Piperidine | 285.1364935 | -0.9494 | 2.89 | 3.167 | 2 | 0 | 38.77 | 4 | 3 | 21 | 0 |
TCMC4170 | C17H19NO3 | 1-[1-Oxo-5(3,4-Methylenedioxyphenyl)-2E,4Z-Pentadienyl]Piperidine | 285.1364935 | -0.9494 | 2.89 | 3.167 | 2 | 0 | 38.77 | 4 | 3 | 21 | 0 |
TCMC4218 | C16H11NO3 | Piperolactam A | 265.0738932 | -1.1469 | 2.78 | 2.86 | 2 | 2 | 58.56 | 1 | 4 | 20 | 0 |
TCMC4276 | C18H16O6 | 5-Hydroxy-7,3',4'-Trimethoxyflavone | 328.0946882 | -0.7523 | 2.78 | 1.72 | 1 | 1 | 64.99 | 4 | 3 | 24 | 0 |
TCMC4437 | C20H20O6 | Xanthoxylol | 356.1259884 | -1.8128 | 3 | 2.13 | 2 | 1 | 66.38 | 3 | 5 | 26 | 0 |
TCMC4716 | C10H16O | Cis-P-2,8-Menthadien-1-Ol | 152.1201151 | 1.7929 | 2.45 | 2.068 | 1 | 1 | 20.23 | 1 | 1 | 11 | 0 |
TCMC4717 | C10H16O | 3,8(9)-P-Menthadien-1-Ol | 152.1201151 | 1.5008 | 2.45 | 2.184 | 1 | 1 | 20.23 | 1 | 1 | 11 | 0 |
TCMC5152 | C12H21NO | N-Isobutyl-(2E,4E)-Octadienamide | 195.1623143 | 0.7975 | 2.56 | 3.331 | 2 | 1 | 29.1 | 7 | 0 | 14 | 0 |
TCMC5260 | C13H12O4 | Methyl Piperate | 232.0735589 | 0.5374 | 2.45 | 2.692 | 2 | 0 | 44.76 | 4 | 2 | 17 | 0 |
TCMC5261 | C19H28O2 | Pipataline | 288.2089301 | -1.832 | 3.33 | 8.267 | 0 | 0 | 18.46 | 10 | 2 | 21 | 1 |
TCMC5268 | C15H19NO3 | 1-[1-Oxo-3(3,4-Methylenedioxyphenyl)Propyl]Piperidine | 261.1364935 | -1.6811 | 2.67 | 2.218 | 2 | 0 | 38.77 | 4 | 3 | 19 | 0 |
TCMC5271 | C22H41NO | N-Isobutyl-(2E,4E)-Octadecadienamide | 335.3188149 | -2.0825 | 3.66 | 9.021 | 2 | 1 | 29.1 | 17 | 0 | 24 | 2 |
TCMC5272 | C21H27NO3 | 1-[1-Oxo-9(3,4-Methylenedioxyphenyl)-2E,8E- Nonadienyl] Piperidine,Pipernonaline | 341.1990937 | -1.0142 | 3.33 | 5.371 | 2 | 0 | 38.77 | 8 | 3 | 25 | 1 |
TCMC5337 | C19H21NO3 | Piperettine | 311.1521435 | -0.4816 | 3.11 | 3.861 | 2 | 0 | 38.77 | 5 | 3 | 23 | 0 |
TCMC5359 | C24H43NO | N-Isobutyl-(2E,4E,14Z)-Eicosatrienamide | 361.334465 | -0.5275 | 3.88 | 9.643 | 2 | 1 | 29.1 | 18 | 0 | 26 | 2 |
TCMC5544 | C18H23NO3 | Piperamide C 7:1(6E) | 301.1677936 | -1.3081 | 3 | 3.986 | 2 | 0 | 38.77 | 7 | 3 | 22 | 0 |
TCMC5547 | C15H27NO | 1-(1-Oxo-2E-Decaenyl) Piperidine | 237.2092645 | -2.2476 | 2.89 | 4.841 | 2 | 0 | 20.31 | 8 | 1 | 17 | 0 |
TCMC5559 | C16H27NO | 1-(1-Oxo-2E,4E-Dodedienyl)Pyrrolidine | 249.2092645 | -1.4918 | 3 | 5.177 | 2 | 0 | 20.31 | 9 | 1 | 18 | 1 |
TCMC5582 | C23H28O7 | Rel-(7R,8R,7'R,8'R)-3',4'-Methylenedioxy-3,4,5,5'-Tetramethoxy-7,7'-Epoxylignan | 416.1835032 | -0.498 | 3.22 | 3.007 | 1 | 0 | 64.61 | 6 | 4 | 30 | 0 |
TCMC5598 | C15H25NO | Neopellitorine B | 235.1936144 | -1.2038 | 2.89 | 4.397 | 2 | 0 | 20.31 | 7 | 1 | 17 | 0 |
TCMC5606 | C19H25NO3 | Piperolein A | 315.1834437 | -1.5961 | 3.11 | 4.344 | 2 | 0 | 38.77 | 7 | 3 | 23 | 0 |
TCMC5609 | C15H27NO3 | (±)-Erythro-1-(1-Oxo-4,5-Dihydroxy-2E-Decaenyl)Piperidine | 269.1990937 | -3.2366 | 2.67 | 2.203 | 4 | 2 | 60.77 | 8 | 1 | 19 | 0 |
TCMC5623 | C15H27NO3 | (±)-Threo-1-(1-Oxo-4,5-Dihydroxy-2E-Decaenyl)Piperidine | 269.1990937 | -3.2366 | 2.67 | 2.203 | 4 | 2 | 60.77 | 8 | 1 | 19 | 0 |
TCMC5636 | C24H43NO | Pipnoohine | 361.334465 | 0.0161 | 3.88 | 9.854 | 2 | 1 | 29.1 | 18 | 0 | 26 | 2 |
TCMC5637 | C24H33NO3 | Pipyahyine | 383.2460439 | 0.3029 | 3.66 | 7.486 | 2 | 1 | 47.56 | 13 | 2 | 28 | 2 |
TCMC5662 | C18H18O2 | (7S,8R)-4-Hydroxy-4',7-Epoxy-8,3'-Neolignan-(7E)-Ene | 266.1306798 | 0.3759 | 3.22 | 5.462 | 0 | 1 | 29.46 | 2 | 3 | 20 | 1 |
TCMC5668 | C15H23NO2 | 1-(1,6-Dioxo-2E,4E-Decadienyl)Piperidine | 249.172879 | -1.5071 | 2.78 | 2.305 | 3 | 0 | 37.38 | 7 | 1 | 18 | 0 |
TCMC5694 | C16H19NO4 | 1-[1-Oxo-3(3,4-Methylenedioxy-5-Methoxyphenyl)-2Zpropenyl] Piperidine | 289.1314081 | -1.469 | 2.67 | 2.029 | 2 | 0 | 48 | 4 | 3 | 21 | 0 |
TCMC5700 | C10H16O | 1(7),2-P-Menthadien-6-Ol | 152.1201151 | 0.9914 | 2.45 | 2.442 | 1 | 1 | 20.23 | 1 | 1 | 11 | 0 |
TCMC5702 | C12H23NO3 | (±)-Threo-N-Isobutyl-4,5-Dihydroxy-2E-Octaenamide | 229.1677936 | -1.2353 | 2.34 | 1.137 | 4 | 3 | 69.56 | 8 | 0 | 16 | 0 |
TCMC5710 | C16H17NO3 | 1-[1-Oxo-5(3,4-Methylenedioxyphenyl)-2Z,4E-Pentadienyl] Pyrrolidine | 271.1208434 | -0.6614 | 2.78 | 2.809 | 2 | 0 | 38.77 | 4 | 3 | 20 | 0 |
TCMC5794 | C18H19NO3 | 1-[1-Oxo-7(3,4-Methylenedioxyphenyl)-2E,4E,6E-Heptatrienyl]Pyrrolidine | 297.1364935 | -0.1936 | 3 | 3.503 | 2 | 0 | 38.77 | 5 | 3 | 22 | 0 |
TCMC5869 | C16H19NO3 | Piperamine | 273.1364935 | -0.8112 | 2.78 | 2.887 | 2 | 0 | 38.77 | 5 | 3 | 20 | 0 |
TCMC6216 | C21H20O7 | Piperenol A | 384.120903 | -1.4809 | 3 | 4.259 | 7 | 3 | 113.29 | 7 | 3 | 28 | 0 |
TCMC6246 | C16H17NO5 | 4'-Desmethylpiplartine | 303.1106726 | -0.8764 | 2.56 | 0.814 | 3 | 1 | 76.07 | 5 | 2 | 22 | 0 |
TCMC6247 | C16H17NO5 | Cenocladamide | 303.1106726 | -1.2149 | 2.56 | 0.426 | 3 | 1 | 76.07 | 5 | 2 | 22 | 0 |
TCMC6404 | C20H27NO3 | Piperamide C 9:1(8E) | 329.1990937 | -1.8841 | 3.22 | 5.124 | 2 | 0 | 38.77 | 9 | 3 | 24 | 1 |
TCMC6624 | C22H39NO | N-Isobutyl-2E,4E,12Z-Octadecatrienamide | 333.3031649 | 0.0485 | 3.66 | 8.505 | 2 | 1 | 29.1 | 16 | 0 | 24 | 2 |
TCMC6698 | C23H31NO3 | Piperchabamide B | 369.2303939 | -1.5902 | 3.55 | 6.509 | 2 | 0 | 38.77 | 10 | 3 | 27 | 1 |
TCMC6699 | C14H15NO2 | Piperchabamide A | 229.1102787 | -0.5764 | 2.67 | 3.676 | 3 | 0 | 37.38 | 4 | 2 | 17 | 0 |
TCMC6700 | C25H33NO3 | Piperchabamide C | 395.2460439 | -1.1224 | 3.77 | 7.203 | 2 | 0 | 38.77 | 11 | 3 | 29 | 2 |
TCMC6909 | C16H27NO4 | Zp-Amide C | 297.1940083 | 0.3484 | 2.67 | 1.332 | 5 | 4 | 89.79 | 10 | 0 | 21 | 0 |
TCMC6912 | C16H27NO4 | Zp-Amide D | 297.1940083 | 0.3484 | 2.67 | 1.332 | 5 | 4 | 89.79 | 10 | 0 | 21 | 0 |
TCMC6961 | C15H24 | Sesquisabinene | 204.1878008 | 2.658 | 3.11 | 6.149 | 0 | 0 | 0 | 4 | 2 | 15 | 1 |
TCMC7057 | C19H18O3 | (7R,8R)-3,4-Methylenedioxy-4',7-Epoxy-8,3'-Neolignan-7'E-Ene | 294.1255944 | 0.5335 | 3.22 | 5.464 | 0 | 0 | 27.69 | 2 | 4 | 22 | 1 |
TCMC7058 | C17H16O4 | Methyl-(7R,8R)-4-Hydroxy-8',9'-Dinor-4',7-Epoxy-8,3'-Neolignan-7'-Ate | 284.104859 | -0.5202 | 2.89 | 3.393 | 2 | 1 | 55.76 | 3 | 3 | 21 | 0 |
TCMC7059 | C16H14O3 | (7S,8R)-4-Hydroxy-8',9'-Dinor-4',7-Epoxy-8,3'-Neolignan-7'-Aldehyde | 254.0942943 | -0.7238 | 2.89 | 3.486 | 1 | 1 | 46.53 | 2 | 3 | 19 | 0 |
TCMC7116 | C16H25NO4 | Zp-Amide A | 295.1783583 | -0.0964 | 2.67 | 0.586 | 5 | 3 | 86.63 | 10 | 0 | 21 | 0 |
TCMC7117 | C16H25NO4 | Zp-Amide B | 295.1783583 | 0.2678 | 2.67 | 0.481 | 5 | 3 | 86.63 | 10 | 0 | 21 | 0 |
TCMC7118 | C16H27NO4 | Zp-Amide E | 297.1940083 | -0.1952 | 2.67 | 0.754 | 5 | 4 | 89.79 | 10 | 0 | 21 | 0 |