Description of the Component
Component ID |
TCMH158 |
Latin Name |
Piper longum |
English Name |
Long pepper |
Chinese Pinyin Name |
Bi Ba |
中文名 |
荜茇 |
TCM Properties |
|
TCM Meridians |
|
Therapeutic Class English |
|
Therapeutic Class Chinese |
|
Functions |
|
Toxicity |
NA |
Geo-authentic habitats (道地产区) |
NA |
Reference |
Chinese Pharmacopoeia (2015) |
Barcode ID |
ITSAJ4247-14 |
Barcode Source |
BOLDSYSTEMS |
TCM Prescriptions with the Component
| Prescription ID | Prescription English Name | Prescription Chinese Name |
|---|---|---|
| TCMF171 | Shi Wei Shi Liu Pills | 十味石榴丸 |
| TCMF266 | Wu Wei Qing Zhuo Powder | 五味清浊散 |
| TCMF2931 | An Kang Xin Bao Pills | 安康心宝丸 |
| TCMF3822 | Du Tong Pills | 肚痛丸 |
| TCMF406 | Shi Liu Jian Wei Powder | 石榴健胃散 |
| TCMF4497 | Hong Mao Yao Wine | 鸿茅药酒 |
| TCMF4717 | Jie Biao Zhui Feng Pills | 解表追风丸 |
| TCMF5069 | Qu Feng Su He Pills | 驱风苏合丸 |
| TCMF5425 | Wang Hui Hui Gou Pi Ointment | 王回回狗皮膏 |
| TCMF546 | Su He Xiang Pills | 苏合香丸 |
Showing 1 to 10 of 32 entries
Targeted Human Proteins by the Ingredient of Component
| Target ID | Gene Symbol | Target Name | Target Class | Uniprot ID |
|---|---|---|---|---|
| TCMT100 | TTR | Transthyretin | Unclassified | P02766 |
| TCMT176 | SOAT1 | Acyl coenzyme A:cholesterol acyltransferase 1 | Transferase | P35610 |
| TCMT2 | MAPT | Microtubule-associated protein tau | Unclassified | P10636 |
| TCMT289 | TBXAS1 | Thromboxane-A synthase | Isomerase | P24557 |
| 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 |
| TCMT555 | HDAC6 | Histone deacetylase 6 | Hydrolase | Q9UBN7 |
| TCMT557 | HDAC1 | Histone deacetylase 1 | Hydrolase | Q13547 |
Showing 1 to 10 of 15 entries
Targeted Pathogenic Microbes by the Ingredient of Component
| 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 |
| TCMT1289 | Shigella dysenteriae |
| TCMT1438 | Plasmodium falciparum |
| TCMT1454 | Bacillus subtilis |
Showing 1 to 9 of 9 entries
Ingredient Structrues
Ingredient ID: TCMC6956
Formula: C24H33NO3
Ingredient ID: TCMC6956
| Common Name | Sylvatine |
| IUPAC Name | (2E,4E)-5-(1,3-benzodioxol-5-yl)-N-[(E)-10-methylundec-5-enyl]penta-2,4-dienamide |
| Canonical SMILES | CC(CCC/C=C/CCCCNC(=O)/C=C/C=C/c1ccc2c(c1)OCO2)C |
| Standard InCHI | InChI=1S/C24H33NO3/c1-20(2)12-8-6-4-3-5-7-11-17-25-24(26)14-10-9-13-21-15-16-22-23(18-21)28-19-27-22/h3-4,9-10,13-16,18,20H,5-8,11-12,17,19H2,1-2H3,(H,25,26)/b4-3+,13-9+,14-10+ |
| Standard InCHIKey | URFYPQQKBYOWIX-UDNGMWKQSA-N |
| External Identifiers | ChEMBL [N/A]; PubChem [90472536]; |
| Reference of Component-Ingredient Pair | 21704957 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC6697
Formula: C23H29NO3
Ingredient ID: TCMC6697
| Common Name | Piperundecalidine |
| IUPAC Name | (2E,4E,10E)-11-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylundeca-2,4,10-trien-1-one |
| Canonical SMILES | O=C(N1CCCCC1)/C=C/C=C/CCCC/C=C/c1ccc2c(c1)OCO2 |
| Standard InCHI | InChI=1S/C23H29NO3/c25-23(24-16-10-7-11-17-24)13-9-6-4-2-1-3-5-8-12-20-14-15-21-22(18-20)27-19-26-21/h4,6,8-9,12-15,18H,1-3,5,7,10-11,16-17,19H2/b6-4+,12-8+,13-9+ |
| Standard InCHIKey | BADLEYLQAILHPV-AZMZBSBOSA-N |
| External Identifiers | ChEMBL [CHEMBL255762]; PubChem [44453654]; |
| Reference of Component-Ingredient Pair | 21704957 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC6373
Formula: C18H26O2
Ingredient ID: TCMC6373
| Common Name | 1-Undecylenyl-3,4-Methylenedioxybenzene |
| IUPAC Name | 5-undec-10-enyl-1,3-benzodioxole |
| Canonical SMILES | C=CCCCCCCCCCc1ccc2c(c1)OCO2 |
| Standard InCHI | InChI=1S/C18H26O2/c1-2-3-4-5-6-7-8-9-10-11-16-12-13-17-18(14-16)20-15-19-17/h2,12-14H,1,3-11,15H2 |
| Standard InCHIKey | TUOVWZLZRGOMKY-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [N/A]; PubChem [21159019]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC5272
Formula: C21H27NO3
Ingredient ID: TCMC5272
| Common Name | 1-[1-Oxo-9(3,4-Methylenedioxyphenyl)-2E,8E- Nonadienyl] Piperidine,Pipernonaline |
| IUPAC Name | (2E,8E)-9-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylnona-2,8-dien-1-one |
| Canonical SMILES | O=C(N1CCCCC1)/C=C/CCCC/C=C/c1ccc2c(c1)OCO2 |
| Standard InCHI | InChI=1S/C21H27NO3/c23-21(22-14-8-5-9-15-22)11-7-4-2-1-3-6-10-18-12-13-19-20(16-18)25-17-24-19/h6-7,10-13,16H,1-5,8-9,14-15,17H2/b10-6+,11-7+ |
| Standard InCHIKey | PKLGRWSJBLGIBF-JMQWPVDRSA-N |
| External Identifiers | ChEMBL [CHEMBL450332]; PubChem [9974595]; |
| Reference of Component-Ingredient Pair | 27452451 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC5104
Formula: C21H25NO3
Ingredient ID: TCMC5104
| Common Name | Dehydropipernonaline |
| IUPAC Name | (2E,4E,8E)-9-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylnona-2,4,8-trien-1-one |
| Canonical SMILES | O=C(N1CCCCC1)/C=C/C=C/CC/C=C/c1ccc2c(c1)OCO2 |
| Standard InCHI | InChI=1S/C21H25NO3/c23-21(22-14-8-5-9-15-22)11-7-4-2-1-3-6-10-18-12-13-19-20(16-18)25-17-24-19/h2,4,6-7,10-13,16H,1,3,5,8-9,14-15,17H2/b4-2+,10-6+,11-7+ |
| Standard InCHIKey | KAYVDASZRFLFRZ-PQECNABGSA-N |
| External Identifiers | ChEMBL [CHEMBL483708]; PubChem [6439947]; |
| Reference of Component-Ingredient Pair | 17188313 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC4882
Formula: C12H14O4
Ingredient ID: TCMC4882
| Common Name | Tetrahydropiperic Acid |
| IUPAC Name | 5-(1,3-benzodioxol-5-yl)pentanoic acid |
| Canonical SMILES | [O-]C(=O)CCCCc1ccc2c(c1)OCO2 |
| Standard InCHI | InChI=1S/C12H14O4/c13-12(14)4-2-1-3-9-5-6-10-11(7-9)16-8-15-10/h5-7H,1-4,8H2,(H,13,14)/p-1 |
| Standard InCHIKey | VSLFLWQBWGEPBW-UHFFFAOYSA-M |
| External Identifiers | ChEMBL [N/A]; PubChem [5321853]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC3025
Formula: C16H34
Ingredient ID: TCMC3025
| Common Name | Hexadecane |
| IUPAC Name | hexadecane |
| Canonical SMILES | CCCCCCCCCCCCCCCC |
| Standard InCHI | InChI=1S/C16H34/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h3-16H2,1-2H3 |
| Standard InCHIKey | DCAYPVUWAIABOU-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [CHEMBL134994]; PubChem [11006]; |
| Reference of Component-Ingredient Pair | 22909967 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1219 | Semen armeniacae amarum | Ku Xing Ren | 苦杏仁 |
| TCMH1466 | Rosa rugosa | Mei Gui Hua | 玫瑰花 |
| TCMH158 | Piper longum | Bi Ba | 荜茇 |
| TCMH1721 | Panax ginseng | Ren Shen | 人参 |
| TCMH1768 | Panax notoginseng | San Qi | 三七 |
| TCMH1835 | Kaempferia galanga | Shan Nai | 山柰 |
| TCMH2241 | Panax quinquefolium | Xi Yang Shen | 西洋参 |
Showing 1 to 7 of 7 entries
Ingredient ID: TCMC2955
Formula: C5H11N
Ingredient ID: TCMC2955
| Common Name | Piperidine |
| IUPAC Name | piperidine |
| Canonical SMILES | C1CCC[NH2+]C1 |
| Standard InCHI | InChI=1S/C5H11N/c1-2-4-6-5-3-1/h6H,1-5H2/p+1 |
| Standard InCHIKey | NQRYJNQNLNOLGT-UHFFFAOYSA-O |
| External Identifiers | ChEMBL [CHEMBL15487]; PubChem [8082]; |
| Reference of Component-Ingredient Pair | 23449869 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC2716
Formula: C26H37NO3
Ingredient ID: TCMC2716
| Common Name | Brachystamide B |
| IUPAC Name | (2E,4E,14E)-15-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)pentadeca-2,4,14-trienamide |
| Canonical SMILES | CC(CN=C(/C=C/C=C/CCCCCCCC/C=C/c1ccc2c(c1)OCO2)O)C |
| Standard InCHI | InChI=1S/C26H37NO3/c1-22(2)20-27-26(28)16-14-12-10-8-6-4-3-5-7-9-11-13-15-23-17-18-24-25(19-23)30-21-29-24/h10,12-19,22H,3-9,11,20-21H2,1-2H3,(H,27,28)/b12-10+,15-13+,16-14+ |
| Standard InCHIKey | DRMOIHOBUYFDKF-HMZUNPFJSA-N |
| External Identifiers | ChEMBL [CHEMBL271448]; PubChem [10047263]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC2597
Formula: C14H23NO
Ingredient ID: TCMC2597
| Common Name | Sarmentine |
| IUPAC Name | (2E,4E)-1-pyrrolidin-1-yldeca-2,4-dien-1-one |
| Canonical SMILES | CCCCC/C=C/C=C/C(=O)N1CCCC1 |
| Standard InCHI | InChI=1S/C14H23NO/c1-2-3-4-5-6-7-8-11-14(16)15-12-9-10-13-15/h6-8,11H,2-5,9-10,12-13H2,1H3/b7-6+,11-8+ |
| Standard InCHIKey | BFZBGTMIBOQWBA-HRCSPUOPSA-N |
| External Identifiers | ChEMBL [CHEMBL2205104]; PubChem [6440616]; |
| Reference of Component-Ingredient Pair | 20839888 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1045 | Piper sarmentosum | Jia Ju | 假蒟 |
| TCMH1051 | Piper sarmentosum | Jia 蒟ye | 假蒟叶 |
| TCMH158 | Piper longum | Bi Ba | 荜茇 |
| TCMH2715 | Ardisia japonica | Zi Jin Niu | 紫金牛 |
| TCMH64 | Piper nigrum | Bai Hu Jiao | 白胡椒 |
| TCMH839 | Piper nigrum | Hei Hu Jiao | 黑胡椒 |
| TCMH907 | Piper nigrum | Hu Jiao | 胡椒 |
Showing 1 to 7 of 7 entries
Ingredient ID: TCMC2507
Formula: C20H25NO3
Ingredient ID: TCMC2507
| Common Name | Brachyamide B |
| IUPAC Name | (2E,8E)-9-(1,3-benzodioxol-5-yl)-1-pyrrolidin-1-ylnona-2,8-dien-1-one |
| Canonical SMILES | O=C(N1CCCC1)/C=C/CCCC/C=C/c1ccc2c(c1)OCO2 |
| Standard InCHI | InChI=1S/C20H25NO3/c22-20(21-13-7-8-14-21)10-6-4-2-1-3-5-9-17-11-12-18-19(15-17)24-16-23-18/h5-6,9-12,15H,1-4,7-8,13-14,16H2/b9-5+,10-6+ |
| Standard InCHIKey | BYKNKNBUHGFXQF-NXZHAISVSA-N |
| External Identifiers | ChEMBL [CHEMBL1669576]; PubChem [14162526]; |
| Reference of Component-Ingredient Pair | 15234750 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC2381
Formula: C8H10O
Ingredient ID: TCMC2381
| Common Name | Phenylethyl Alcohol |
| IUPAC Name | 2-phenylethanol |
| Canonical SMILES | OCCc1ccccc1 |
| Standard InCHI | InChI=1S/C8H10O/c9-7-6-8-4-2-1-3-5-8/h1-5,9H,6-7H2 |
| Standard InCHIKey | WRMNZCZEMHIOCP-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [CHEMBL448500]; PubChem [6054]; |
| Reference of Component-Ingredient Pair | 22980851 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1127 | Lonicera japonica | Jin Yin Hua | 金银花 |
| TCMH1128 | Lonicera japonica | Jin Yin Hua Ti Qu Ye | 金银花提取液 |
| TCMH114 | Platycladus orientalis | Bai Ye | 柏叶 |
| TCMH1175 | Cornus officinalis | Jiu Yu Rou | 酒萸肉 |
| TCMH12 | Artemisia argyi | Ai Ye | 艾叶 |
| TCMH120 | Atractylodes macrocephala | Bai Zhu | 白术 |
| TCMH1264 | Litchi chinensis | Li Zhi He | 荔枝核 |
| TCMH13 | Artemisia argyi | Ai Ye You | 艾叶油 |
| TCMH1343 | Aloe vera | Lu Hui | 芦荟 |
| TCMH1466 | Rosa rugosa | Mei Gui Hua | 玫瑰花 |
Showing 1 to 10 of 61 entries
Ingredient ID: TCMC2067
Formula: C7H6O3
Ingredient ID: TCMC2067
| Common Name | Sesamol |
| IUPAC Name | 1,3-benzodioxol-5-ol |
| Canonical SMILES | Oc1ccc2c(c1)OCO2 |
| Standard InCHI | InChI=1S/C7H6O3/c8-5-1-2-6-7(3-5)10-4-9-6/h1-3,8H,4H2 |
| Standard InCHIKey | LUSZGTFNYDARNI-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [CHEMBL1517998]; PubChem [68289]; |
| Reference of Component-Ingredient Pair | 22577367 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1420 | Oleum sesami | Ma You | 麻油 |
| TCMH158 | Piper longum | Bi Ba | 荜茇 |
| TCMH2082 | Acanthopanax gracilistylus | Teng Wu Jia Gen | 藤五加根 |
| TCMH2139 | Acanthopanax gracilistylus | Tu Jia Pi | 土加皮 |
| TCMH2152 | Acanthopanax gracilistylus | Tu Wu Jia | 土五加 |
| TCMH2185 | Acanthopanax gracilistylus | Wu Jia Pi | 五加皮 |
| TCMH2239 | Asarum sieboldii | Xi Xin | 细辛 |
| TCMH2621 | Semen sesami | Zhi Ma | 芝麻 |
| TCMH2623 | Oleum sesami | Zhi Ma You | 芝麻油 |
| TCMH327 | Eleutherococcus senticosus | Ci Wu Jia | 刺五加 |
Showing 1 to 10 of 17 entries
Ingredient ID: TCMC2066
Formula: C20H18O6
Ingredient ID: TCMC2066
| Common Name | Sesamin |
| IUPAC Name | 5-[(3S,3aR,6S,6aR)-3-(1,3-benzodioxol-5-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-1,3-benzodioxole |
| Canonical SMILES | C1Oc2c(O1)cc(cc2)[C@H]1OC[C@H]2[C@@H]1CO[C@@H]2c1ccc2c(c1)OCO2 |
| Standard InCHI | InChI=1S/C20H18O6/c1-3-15-17(25-9-23-15)5-11(1)19-13-7-22-20(14(13)8-21-19)12-2-4-16-18(6-12)26-10-24-16/h1-6,13-14,19-20H,7-10H2/t13-,14-,19+,20+/m0/s1 |
| Standard InCHIKey | PEYUIKBAABKQKQ-AFHBHXEDSA-N |
| External Identifiers | ChEMBL [CHEMBL252915]; PubChem [72307]; |
| Reference of Component-Ingredient Pair | 23337743 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1045 | Piper sarmentosum | Jia Ju | 假蒟 |
| TCMH1051 | Piper sarmentosum | Jia 蒟ye | 假蒟叶 |
| TCMH1187 | Gynura japonica | Ju San Qi | 菊三七 |
| TCMH1191 | Gynura japonica | Ju Ye San Qi | 菊叶三七 |
| TCMH1305 | Laggera alata | Liu Ling Ju | 六棱菊 |
| TCMH1460 | Zanthoxylum nitidum | Mao Liang Mian Zhen | 毛两面针 |
| TCMH158 | Piper longum | Bi Ba | 荜茇 |
| TCMH2148 | Cuscuta australis | Tu Si Rou | 菟丝肉 |
| TCMH2149 | Cuscuta australis | Tu Si Zi | 菟丝子 |
| TCMH2150 | Cuscuta australis | Tu Si Zi Teng | 菟丝子藤 |
Showing 1 to 10 of 31 entries
Ingredient ID: TCMC2009
Formula: C22H29NO3
Ingredient ID: TCMC2009
| Common Name | Retrofractamide B |
| IUPAC Name | (2E,4E,10E)-11-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)undeca-2,4,10-trienamide |
| Canonical SMILES | CC(CN=C(/C=C/C=C/CCCC/C=C/c1ccc2c(c1)OCO2)O)C |
| Standard InCHI | InChI=1S/C22H29NO3/c1-18(2)16-23-22(24)12-10-8-6-4-3-5-7-9-11-19-13-14-20-21(15-19)26-17-25-20/h6,8-15,18H,3-5,7,16-17H2,1-2H3,(H,23,24)/b8-6+,11-9+,12-10+ |
| Standard InCHIKey | RPOYGOULCHMVBB-ADDDGJNWSA-N |
| External Identifiers | ChEMBL [CHEMBL257943]; PubChem [5372162]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC2008
Formula: C20H25NO3
Ingredient ID: TCMC2008
| Common Name | Retrofractamide A |
| IUPAC Name | (2E,4E,8E)-9-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)nona-2,4,8-trienamide |
| Canonical SMILES | CC(CN=C(/C=C/C=C/CC/C=C/c1ccc2c(c1)OCO2)O)C |
| Standard InCHI | InChI=1S/C20H25NO3/c1-16(2)14-21-20(22)10-8-6-4-3-5-7-9-17-11-12-18-19(13-17)24-15-23-18/h4,6-13,16H,3,5,14-15H2,1-2H3,(H,21,22)/b6-4+,9-7+,10-8+ |
| Standard InCHIKey | BPSWISYORIWKCT-FCGWLDPVSA-N |
| External Identifiers | ChEMBL [CHEMBL255152]; PubChem [11012859]; |
| Reference of Component-Ingredient Pair | 23910984 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC1909
Formula: C17H19NO5
Ingredient ID: TCMC1909
| Common Name | Piplartine |
| IUPAC Name | 1-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]-2,3-dihydropyridin-6-one |
| Canonical SMILES | COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(c1OC)OC |
| Standard InCHI | InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ |
| Standard InCHIKey | VABYUUZNAVQNPG-BQYQJAHWSA-N |
| External Identifiers | ChEMBL [CHEMBL465843]; PubChem [637858]; |
| Reference of Component-Ingredient Pair | 28913568 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC1905
Formula: C16H19NO3
Ingredient ID: TCMC1905
| Common Name | Piperlonguminine |
| IUPAC Name | (2E,4E)-5-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)penta-2,4-dienamide |
| Canonical SMILES | CC(CN=C(/C=C/C=C/c1ccc2c(c1)OCO2)O)C |
| Standard InCHI | InChI=1S/C16H19NO3/c1-12(2)10-17-16(18)6-4-3-5-13-7-8-14-15(9-13)20-11-19-14/h3-9,12H,10-11H2,1-2H3,(H,17,18)/b5-3+,6-4+ |
| Standard InCHIKey | WHAAPCGHVWVUEX-GGWOSOGESA-N |
| External Identifiers | ChEMBL [CHEMBL253973]; PubChem [5320621]; |
| Reference of Component-Ingredient Pair | 24194261 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC1904
Formula: C17H19NO3
Ingredient ID: TCMC1904
| Common Name | Piperine |
| IUPAC Name | (2E,4E)-5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpenta-2,4-dien-1-one |
| Canonical SMILES | O=C(N1CCCCC1)/C=C/C=C/c1ccc2c(c1)OCO2 |
| Standard InCHI | InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+ |
| Standard InCHIKey | MXXWOMGUGJBKIW-YPCIICBESA-N |
| External Identifiers | ChEMBL [CHEMBL43185]; PubChem [638024]; |
| Reference of Component-Ingredient Pair | 29968805 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH158 | Piper longum | Bi Ba | 荜茇 |
| TCMH1734 | Homo sapiens | Ren Zhong Bai | 人中白 |
| TCMH2218 | Rubia cordifolia | Qian Cao Teng | 茜草藤 |
| TCMH2710 | Homo sapiens | Zi He Che | 紫河车 |
| TCMH64 | Piper nigrum | Bai Hu Jiao | 白胡椒 |
| TCMH839 | Piper nigrum | Hei Hu Jiao | 黑胡椒 |
| TCMH907 | Piper nigrum | Hu Jiao | 胡椒 |
Showing 1 to 7 of 7 entries
Ingredient ID: TCMC1903
Formula: C22H31NO3
Ingredient ID: TCMC1903
| Common Name | Piperchabamide D |
| IUPAC Name | (2E,10E)-11-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)undeca-2,10-dienamide |
| Canonical SMILES | CC(CN=C(/C=C/CCCCCC/C=C/c1ccc2c(c1)OCO2)O)C |
| Standard InCHI | InChI=1S/C22H31NO3/c1-18(2)16-23-22(24)12-10-8-6-4-3-5-7-9-11-19-13-14-20-21(15-19)26-17-25-20/h9-15,18H,3-8,16-17H2,1-2H3,(H,23,24)/b11-9+,12-10+ |
| Standard InCHIKey | DOGZABSTLUIXJO-WGDLNXRISA-N |
| External Identifiers | ChEMBL [CHEMBL258114]; PubChem [16041827]; |
| Reference of Component-Ingredient Pair | 28349654 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC1902
Formula: C17H21NO3
Ingredient ID: TCMC1902
| Common Name | Piperanine |
| IUPAC Name | (E)-5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpent-2-en-1-one |
| Canonical SMILES | O=C(N1CCCCC1)/C=C/CCc1ccc2c(c1)OCO2 |
| Standard InCHI | InChI=1S/C17H21NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h3,7-9,12H,1-2,4-6,10-11,13H2/b7-3+ |
| Standard InCHIKey | QHWOFMXDKFORMO-XVNBXDOJSA-N |
| External Identifiers | ChEMBL [CHEMBL256218]; PubChem [5320618]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC1848
Formula: C14H25NO
Ingredient ID: TCMC1848
| Common Name | Pellitorin |
| IUPAC Name | (2E,4E)-N-(2-methylpropyl)deca-2,4-dienamide |
| Canonical SMILES | CCCCC/C=C/C=C/C(=NCC(C)C)O |
| Standard InCHI | InChI=1S/C14H25NO/c1-4-5-6-7-8-9-10-11-14(16)15-12-13(2)3/h8-11,13H,4-7,12H2,1-3H3,(H,15,16)/b9-8+,11-10+ |
| Standard InCHIKey | MAGQQZHFHJDIRE-BNFZFUHLSA-N |
| External Identifiers | ChEMBL [CHEMBL271242]; PubChem [5318516]; |
| Reference of Component-Ingredient Pair | 24077682 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1045 | Piper sarmentosum | Jia Ju | 假蒟 |
| TCMH1051 | Piper sarmentosum | Jia 蒟ye | 假蒟叶 |
| TCMH1175 | Cornus officinalis | Jiu Yu Rou | 酒萸肉 |
| TCMH158 | Piper longum | Bi Ba | 荜茇 |
| TCMH1862 | Cornus officinalis | Shan Zhu Yu | 山茱萸 |
| TCMH2715 | Ardisia japonica | Zi Jin Niu | 紫金牛 |
| TCMH587 | Piper kadsura | Feng Teng | 风藤 |
| TCMH64 | Piper nigrum | Bai Hu Jiao | 白胡椒 |
| TCMH776 | Piper kadsura | Hai Feng Teng | 海风藤 |
| TCMH839 | Piper nigrum | Hei Hu Jiao | 黑胡椒 |
Showing 1 to 10 of 12 entries
Ingredient ID: TCMC1662
Formula: C14H18N2
Ingredient ID: TCMC1662
| Common Name | n.a. |
| IUPAC Name | n.a. |
| Canonical SMILES | C1C[C@@H]2[C@H](C1)c1c3N2CCNCc3ccc1 |
| Standard InCHI | InChI=1S/C14H18N2/c1-3-10-9-15-7-8-16-13-6-2-4-11(13)12(5-1)14(10)16/h1,3,5,11,13,15H,2,4,6-9H2/t11-,13-/m1/s1 |
| Standard InCHIKey | XOSKJKGKWRIMGV-DGCLKSJQSA-N |
| External Identifiers | ChEMBL [CHEMBL1628670]; PubChem [10130594]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC1299
Formula: C24H33NO3
Ingredient ID: TCMC1299
| Common Name | Guineensine |
| IUPAC Name | (2E,4E,12E)-13-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)trideca-2,4,12-trienamide |
| Canonical SMILES | CC(CN=C(/C=C/C=C/CCCCCC/C=C/c1ccc2c(c1)OCO2)O)C |
| Standard InCHI | InChI=1S/C24H33NO3/c1-20(2)18-25-24(26)14-12-10-8-6-4-3-5-7-9-11-13-21-15-16-22-23(17-21)28-19-27-22/h8,10-17,20H,3-7,9,18-19H2,1-2H3,(H,25,26)/b10-8+,13-11+,14-12+ |
| Standard InCHIKey | FPMPOFBEYSSYDQ-AUVZEZIHSA-N |
| External Identifiers | ChEMBL [CHEMBL404184]; PubChem [6442405]; |
| Reference of Component-Ingredient Pair | 28942644 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1045 | Piper sarmentosum | Jia Ju | 假蒟 |
| TCMH1051 | Piper sarmentosum | Jia 蒟ye | 假蒟叶 |
| TCMH158 | Piper longum | Bi Ba | 荜茇 |
| TCMH2715 | Ardisia japonica | Zi Jin Niu | 紫金牛 |
| TCMH64 | Piper nigrum | Bai Hu Jiao | 白胡椒 |
| TCMH839 | Piper nigrum | Hei Hu Jiao | 黑胡椒 |
| TCMH907 | Piper nigrum | Hu Jiao | 胡椒 |
Showing 1 to 7 of 7 entries
Ingredient ID: TCMC100
Formula: C17H19NO3
Ingredient ID: TCMC100
| Common Name | (2Z,4Z)-5-(1,3-Benzodioxol-5-Yl)-1-Piperidin-1-Ylpenta-2,4-Dien-1-One |
| IUPAC Name | (2Z,4Z)-5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpenta-2,4-dien-1-one |
| Canonical SMILES | O=C(N1CCCCC1)/C=CC=C/c1ccc2c(c1)OCO2 |
| Standard InCHI | InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2-,7-3- |
| Standard InCHIKey | MXXWOMGUGJBKIW-PORYWJCVSA-N |
| External Identifiers | ChEMBL [CHEMBL1395862]; PubChem [1548912]; |
| Reference of Component-Ingredient Pair | 27396401 |
Occurrence of the ingredient across TCM components
Properties
| Ingredient ID | Formulae | Name | MW | AlogP | MlogP | XlogP | # HBA | # HBD | PSA | # Rotatable Bond | # Ring | # Heacy Atom | Lipinski RO5 Violation |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 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 |
| TCMC1299 | C24H33NO3 | Guineensine | 383.25 | 0.6319 | 3.66 | 7.693 | 2 | 1 | 51.05 | 15 | 2 | 28 | 2 |
| TCMC1662 | C14H18N2 | 214.15 | -1.0493 | 2.78 | 2.311 | 2 | 1 | 15.27 | 0 | 4 | 16 | 0 | |
| 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 |
| TCMC1903 | C22H31NO3 | Piperchabamide D | 357.23 | 0.1641 | 3.44 | 6.999 | 2 | 1 | 51.05 | 14 | 2 | 26 | 2 |
| 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 |
| 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 |
Showing 1 to 10 of 25 entries
Download Data
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