Description of the Component
Component ID |
TCMH2532 |
Latin Name |
Curcuma aromatica |
English Name |
AromaticTurmeric |
Chinese Pinyin Name |
Yu Jin |
中文名 |
郁金 |
TCM Properties |
Cold,Pungent,Bitter |
TCM Meridians |
Liver,Heart,Gallbladder |
Therapeutic Class English |
Blood activation and stasis removal |
Therapeutic Class Chinese |
活血化淤 |
Functions |
invigorate blood and stop pain, promote qi circulation and release stagnation, cool blood and clear heat in the heart, relieve jaundice and facilitate gall bladder function |
Toxicity |
NA |
Geo-authentic habitats (道地产区) |
Sichuan Province,Chongqing, Zhejiang Province, Guangxi Province |
Reference |
Chinese Pharmacopoeia (2015) |
Barcode ID |
ITSAF2298-14 |
Barcode Source |
BOLDSYSTEMS |
TCM Prescriptions with the Component
| Prescription ID | Prescription English Name | Prescription Chinese Name |
|---|---|---|
| TCMF100 | Niu Huang Qing Gong Pills | 牛黄清宫丸 |
| TCMF1034 | Zi Long Jin Tablet | 紫龙金片 |
| TCMF1118 | Jie Yu An Shen Granules | 解郁安神颗粒 |
| TCMF130 | Qi Dong Yi Xin Granules | 芪冬颐心颗粒 |
| TCMF1362 | Lidan Paishi Tablets | 利胆排石片 |
| TCMF1367 | Jiuqi Niantong Pills | 九气拈痛丸 |
| TCMF1398 | Shugan Hewei Pills | 舒肝和胃丸 |
| TCMF1438 | Shixiang Fansheng Pills | 十香返生丸 |
| TCMF2017 | Liver-Restoring Tablet | 利肝隆片 |
| TCMF2254 | Added Flavor BHDH Decoction | 加味百合地黄汤 |
Showing 1 to 10 of 228 entries
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 |
| TCMT101 | PTPN1 | Protein-tyrosine phosphatase 1B | Hydrolase | P18031 |
| TCMT11 | HIF1A | Hypoxia-inducible factor 1 alpha | Transcription factor | Q16665 |
| TCMT125 | GBA | Beta-glucocerebrosidase | Hydrolase | P04062 |
| TCMT130 | ALOX5 | Arachidonate 5-lipoxygenase | Oxidoreductase | P09917 |
| 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 |
Showing 1 to 10 of 81 entries
Targeted Pathogenic Microbes by the Ingredient of Component
| Target ID | Target Name |
|---|---|
| TCMT1085 | Neuraminidase |
| TCMT1104 | Sortase |
| TCMT1108 | Integrase |
| TCMT1112 | Quinolone resistance protein norA |
| TCMT1181 | Mycobacterium tuberculosis H37Ra |
| TCMT1215 | Pseudomonas aeruginosa PAO1 |
| TCMT1221 | Human herpesvirus 4 |
| TCMT1224 | Proteus mirabilis |
| TCMT1226 | Klebsiella pneumoniae |
| TCMT1246 | Escherichia coli |
Showing 1 to 10 of 17 entries
Ingredient Structrues
Ingredient ID: TCMC962
Formula: C21H20O6
Ingredient ID: TCMC962
| Common Name | Curcumin |
| IUPAC Name | (1E,4Z,6E)-5-hydroxy-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,4,6-trien-3-one |
| Canonical SMILES | COc1cc(/C=C/C(=C/C(=O)/C=C/c2ccc(c(c2)OC)O)/O)ccc1O |
| Standard InCHI | InChI=1S/C21H20O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-13,22,24-25H,1-2H3/b7-3+,8-4+,16-13- |
| Standard InCHIKey | ZIUSSTSXXLLKKK-KOBPDPAPSA-N |
| External Identifiers | ChEMBL [CHEMBL116438]; PubChem [5281767]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1063 | Curcuma longa | Jiang Huang | 姜黄 |
| TCMH1277 | Alpinia officinarum | Liang Jiang | 良姜 |
| TCMH2114 | Adiantum capillus-veneris | Tie Xian Cao | 铁线草 |
| TCMH2532 | Curcuma aromatica | Yu Jin | 郁金 |
| TCMH309 | Curcuma longa | Chuan Yu Jin | 川郁金 |
| TCMH672 | Alpinia officinarum | Gao Liang Jiang | 高良姜 |
| TCMH673 | Alpinia officinarum | Gao Liang Jiang You | 高良姜油 |
Showing 1 to 7 of 7 entries
Ingredient ID: TCMC694
Formula: C19H26O2
Ingredient ID: TCMC694
| Common Name | Androstenedione |
| IUPAC Name | (8R,9S,10R,13S,14S)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione |
| Canonical SMILES | O=C1CC[C@]2(C(=C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2=O)C)C |
| Standard InCHI | InChI=1S/C19H26O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-16H,3-10H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1 |
| Standard InCHIKey | AEMFNILZOJDQLW-QAGGRKNESA-N |
| External Identifiers | ChEMBL [CHEMBL274826]; PubChem [6128]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC6190
Formula: C15H24O3
Ingredient ID: TCMC6190
| Common Name | Zedoarondiol |
| IUPAC Name | (3S,3aS,8S,8aR)-3,8-dihydroxy-3,8-dimethyl-5-propan-2-ylidene-1,2,3a,4,7,8a-hexahydroazulen-6-one |
| Canonical SMILES | CC(=C1C[C@H]2[C@H]([C@@](CC1=O)(C)O)CC[C@]2(C)O)C |
| Standard InCHI | InChI=1S/C15H24O3/c1-9(2)10-7-12-11(5-6-14(12,3)17)15(4,18)8-13(10)16/h11-12,17-18H,5-8H2,1-4H3/t11-,12+,14+,15+/m1/s1 |
| Standard InCHIKey | TXIKNNOOLCGADE-DHMWGJHJSA-N |
| External Identifiers | ChEMBL [CHEMBL2386504]; PubChem [14633000]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC6153
Formula: C15H22O
Ingredient ID: TCMC6153
| Common Name | Turmerone |
| IUPAC Name | (6S)-2-methyl-6-(4-methylcyclohexa-1,4-dien-1-yl)hept-2-en-4-one |
| Canonical SMILES | CC(=CC(=O)C[C@@H](C1=CCC(=CC1)C)C)C |
| Standard InCHI | InChI=1S/C15H22O/c1-11(2)9-15(16)10-13(4)14-7-5-12(3)6-8-14/h5,8-9,13H,6-7,10H2,1-4H3/t13-/m0/s1 |
| Standard InCHIKey | FZPYMZUVXJUAQA-ZDUSSCGKSA-N |
| External Identifiers | ChEMBL [CHEMBL2272665]; PubChem [14367555]; |
| Reference of Component-Ingredient Pair | 23570395 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC61
Formula: C19H22O7
Ingredient ID: TCMC61
| Common Name | (2E,5S,6S,8Z,11S)-5,6,15-Trihydroxy-17-Methoxy-11-Methyl-12-Oxabicyclo[12.4.0]Octadeca-1(14),2,8,15,17-Pentaene-7,13-Dione |
| IUPAC Name | (2E,5S,6S,8Z,11S)-5,6,15-trihydroxy-17-methoxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),2,8,15,17-pentaene-7,13-dione |
| Canonical SMILES | COc1cc2/C=C/C[C@H](O)[C@H](O)C(=O)/C=CC[C@@H](OC(=O)c2c(c1)O)C |
| Standard InCHI | InChI=1S/C19H22O7/c1-11-5-3-7-14(20)18(23)15(21)8-4-6-12-9-13(25-2)10-16(22)17(12)19(24)26-11/h3-4,6-7,9-11,15,18,21-23H,5,8H2,1-2H3/b6-4+,7-3-/t11-,15-,18+/m0/s1 |
| Standard InCHIKey | NEQZWEXWOFPKOT-BYRRXHGESA-N |
| External Identifiers | ChEMBL [CHEMBL1077979]; PubChem [9863776]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC5116
Formula: C15H24O2
Ingredient ID: TCMC5116
| Common Name | (3S,10S)-3-Isopropyl-6,10-Dimethylcyclodec-6-Ene-1,4-Dione,Curdione |
| IUPAC Name | (3S,6E,10S)-6,10-dimethyl-3-propan-2-ylcyclodec-6-ene-1,4-dione |
| Canonical SMILES | C/C/1=CCC[C@H](C)C(=O)C[C@H](C(=O)C1)C(C)C |
| Standard InCHI | InChI=1S/C15H24O2/c1-10(2)13-9-14(16)12(4)7-5-6-11(3)8-15(13)17/h6,10,12-13H,5,7-9H2,1-4H3/b11-6+/t12-,13-/m0/s1 |
| Standard InCHIKey | KDPFMRXIVDLQKX-NHFJXKHHSA-N |
| External Identifiers | ChEMBL [CHEMBL113942]; PubChem [6441391]; |
| Reference of Component-Ingredient Pair | 28653926 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC473
Formula: C10H16O
Ingredient ID: TCMC473
| Common Name | 4,7,7-Trimethylbicyclo[2.2.1]Heptan-3-One |
| IUPAC Name | 4,7,7-trimethylbicyclo[2.2.1]heptan-3-one |
| Canonical SMILES | O=C1CC2C(C1(C)CC2)(C)C |
| Standard InCHI | InChI=1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3 |
| Standard InCHIKey | DSSYKIVIOFKYAU-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [CHEMBL15768]; PubChem [2537]; |
| Reference of Component-Ingredient Pair | 25636489 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1000 | Foeniculum vulgare | Hui Xiang | 茴香 |
| TCMH1063 | Curcuma longa | Jiang Huang | 姜黄 |
| TCMH1178 | Citrus reticulata | Ju He | 橘核 |
| TCMH1184 | Citrus reticulata | Ju Pi | 橘皮 |
| TCMH12 | Artemisia argyi | Ai Ye | 艾叶 |
| TCMH1272 | Forsythia suspensa | Lian Qiao | 连翘 |
| TCMH13 | Artemisia argyi | Ai Ye You | 艾叶油 |
| TCMH132 | Scutellaria barbata | Ban Zhi Lian | 半枝莲 |
| TCMH1343 | Aloe vera | Lu Hui | 芦荟 |
| TCMH1393 | Verbena officinalis | Ma Bian Cao | 马鞭草 |
Showing 1 to 10 of 54 entries
Ingredient ID: TCMC4416
Formula: C10H16O
Ingredient ID: TCMC4416
| Common Name | Camphor |
| IUPAC Name | (1S,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one |
| Canonical SMILES | O=C1C[C@@H]2C([C@]1(C)CC2)(C)C |
| Standard InCHI | InChI=1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3/t7-,10-/m1/s1 |
| Standard InCHIKey | DSSYKIVIOFKYAU-GMSGAONNSA-N |
| External Identifiers | ChEMBL [N/A]; PubChem [5284500]; |
| Reference of Component-Ingredient Pair | 24975258 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC43
Formula: C21H20O6
Ingredient ID: TCMC43
| Common Name | (1E,6E)-1,7-Bis(4-Hydroxy-3-Methoxyphenyl)Hepta-1,6-Diene-3,5-Dione |
| IUPAC Name | (1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione |
| Canonical SMILES | COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(c(c2)OC)O)ccc1O |
| Standard InCHI | InChI=1S/C21H20O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-12,24-25H,13H2,1-2H3/b7-3+,8-4+ |
| Standard InCHIKey | VFLDPWHFBUODDF-FCXRPNKRSA-N |
| External Identifiers | ChEMBL [CHEMBL140]; PubChem [969516]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1063 | Curcuma longa | Jiang Huang | 姜黄 |
| TCMH1734 | Homo sapiens | Ren Zhong Bai | 人中白 |
| TCMH1903 | Zingiber officinale | Sheng Jiang | 生姜 |
| TCMH2114 | Adiantum capillus-veneris | Tie Xian Cao | 铁线草 |
| TCMH2532 | Curcuma aromatica | Yu Jin | 郁金 |
| TCMH2710 | Homo sapiens | Zi He Che | 紫河车 |
| TCMH309 | Curcuma longa | Chuan Yu Jin | 川郁金 |
Showing 1 to 7 of 7 entries
Ingredient ID: TCMC42
Formula: C19H16O4
Ingredient ID: TCMC42
| Common Name | (1E,4Z,6E)-5-Hydroxy-1,7-Bis(4-Hydroxyphenyl)Hepta-1,4,6-Trien-3-One |
| IUPAC Name | (1E,4Z,6E)-5-hydroxy-1,7-bis(4-hydroxyphenyl)hepta-1,4,6-trien-3-one |
| Canonical SMILES | O/C(=CC(=O)/C=C/c1ccc(cc1)O)/C=C/c1ccc(cc1)O |
| Standard InCHI | InChI=1S/C19H16O4/c20-16-7-1-14(2-8-16)5-11-18(22)13-19(23)12-6-15-3-9-17(21)10-4-15/h1-13,20-22H/b11-5+,12-6+,18-13- |
| Standard InCHIKey | YXAKCQIIROBKOP-HSSGTREWSA-N |
| External Identifiers | ChEMBL [CHEMBL131770]; PubChem [5324473]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1063 | Curcuma longa | Jiang Huang | 姜黄 |
| TCMH1277 | Alpinia officinarum | Liang Jiang | 良姜 |
| TCMH2532 | Curcuma aromatica | Yu Jin | 郁金 |
| TCMH309 | Curcuma longa | Chuan Yu Jin | 川郁金 |
| TCMH672 | Alpinia officinarum | Gao Liang Jiang | 高良姜 |
| TCMH673 | Alpinia officinarum | Gao Liang Jiang You | 高良姜油 |
Showing 1 to 6 of 6 entries
Ingredient ID: TCMC3321
Formula: C10H16
Ingredient ID: TCMC3321
| Common Name | D-Camphene |
| IUPAC Name | (1R,4S)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane |
| Canonical SMILES | C=C1[C@H]2CC[C@@H](C1(C)C)C2 |
| Standard InCHI | InChI=1S/C10H16/c1-7-8-4-5-9(6-8)10(7,2)3/h8-9H,1,4-6H2,2-3H3/t8-,9+/m0/s1 |
| Standard InCHIKey | CRPUJAZIXJMDBK-DTWKUNHWSA-N |
| External Identifiers | ChEMBL [CHEMBL510535]; PubChem [92221]; |
| Reference of Component-Ingredient Pair | 20964856 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1141 | Schizonepeta tenuifolia | Jing Jie | 荆芥 |
| TCMH1272 | Forsythia suspensa | Lian Qiao | 连翘 |
| TCMH1397 | Aristolochia debilis | Ma Dou Ling | 马兜铃 |
| TCMH1533 | Saussurea lappa | Mu Xiang | 木香 |
| TCMH188 | Mentha haplocalyx | Bo He | 薄荷 |
| TCMH1903 | Zingiber officinale | Sheng Jiang | 生姜 |
| TCMH2202 | Schisandra chinensis | Wu Wei Zi | 五味子 |
| TCMH2239 | Asarum sieboldii | Xi Xin | 细辛 |
| TCMH2532 | Curcuma aromatica | Yu Jin | 郁金 |
| TCMH2545 | Houttuynia cordata | Yu Xing Cao | 鱼腥草 |
Showing 1 to 10 of 12 entries
Ingredient ID: TCMC3095
Formula: C8H12N2
Ingredient ID: TCMC3095
| Common Name | Chuanxiongzine |
| IUPAC Name | 2,3,5,6-tetramethylpyrazine |
| Canonical SMILES | Cc1nc(C)c(nc1C)C |
| Standard InCHI | InChI=1S/C8H12N2/c1-5-6(2)10-8(4)7(3)9-5/h1-4H3 |
| Standard InCHIKey | FINHMKGKINIASC-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [CHEMBL303697]; PubChem [14296]; |
| Reference of Component-Ingredient Pair | 22972787 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC2142
Formula: C19H28O2
Ingredient ID: TCMC2142
| Common Name | Testosterone |
| IUPAC Name | (8R,9S,10R,13S,14S,17S)-17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one |
| Canonical SMILES | O=C1CC[C@]2(C(=C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@@H]2O)C)C |
| Standard InCHI | InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-17,21H,3-10H2,1-2H3/t14-,15-,16-,17-,18-,19-/m0/s1 |
| Standard InCHIKey | MUMGGOZAMZWBJJ-DYKIIFRCSA-N |
| External Identifiers | ChEMBL [CHEMBL386630]; PubChem [6013]; |
| Reference of Component-Ingredient Pair | 29738703 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC170
Formula: C10H14O
Ingredient ID: TCMC170
| Common Name | (S)(+)Carvone |
| IUPAC Name | (5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-one |
| Canonical SMILES | CC(=C)[C@H]1CC=C(C(=O)C1)C |
| Standard InCHI | InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9H,1,5-6H2,2-3H3/t9-/m0/s1 |
| Standard InCHIKey | ULDHMXUKGWMISQ-VIFPVBQESA-N |
| External Identifiers | ChEMBL [CHEMBL501949]; PubChem [16724]; |
| Reference of Component-Ingredient Pair | 22606841 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1000 | Foeniculum vulgare | Hui Xiang | 茴香 |
| TCMH1063 | Curcuma longa | Jiang Huang | 姜黄 |
| TCMH108 | Perilla frutescens | Bai Su Zi | 白苏子 |
| TCMH1142 | Schizonepetae spica | Jing Jie Sui | 荆芥穗 |
| TCMH1144 | Schizonepetae herba | Jing Jie Tan | 荆芥炭 |
| TCMH1178 | Citrus reticulata | Ju He | 橘核 |
| TCMH1184 | Citrus reticulata | Ju Pi | 橘皮 |
| TCMH12 | Artemisia argyi | Ai Ye | 艾叶 |
| TCMH120 | Atractylodes macrocephala | Bai Zhu | 白术 |
| TCMH13 | Artemisia argyi | Ai Ye You | 艾叶油 |
Showing 1 to 10 of 51 entries
Ingredient ID: TCMC124
Formula: C19H22O7
Ingredient ID: TCMC124
| Common Name | (5E)-7-Oxozeaenol |
| IUPAC Name | (2E,5S,6S,8E,11S)-5,6,15-trihydroxy-17-methoxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(18),2,8,14,16-pentaene-7,13-dione |
| Canonical SMILES | COc1cc2/C=C/C[C@H](O)[C@H](O)C(=O)/C=C/C[C@@H](OC(=O)c2c(c1)O)C |
| Standard InCHI | InChI=1S/C19H22O7/c1-11-5-3-7-14(20)18(23)15(21)8-4-6-12-9-13(25-2)10-16(22)17(12)19(24)26-11/h3-4,6-7,9-11,15,18,21-23H,5,8H2,1-2H3/b6-4+,7-3+/t11-,15-,18+/m0/s1 |
| Standard InCHIKey | NEQZWEXWOFPKOT-ULSULSEOSA-N |
| External Identifiers | ChEMBL [CHEMBL1801950]; PubChem [9799061]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC1157
Formula: C10H18O
Ingredient ID: TCMC1157
| Common Name | Eucalyptol |
| IUPAC Name | 2,2,4-trimethyl-3-oxabicyclo[2.2.2]octane |
| Canonical SMILES | CC12CCC(CC1)C(O2)(C)C |
| Standard InCHI | InChI=1S/C10H18O/c1-9(2)8-4-6-10(3,11-9)7-5-8/h8H,4-7H2,1-3H3 |
| Standard InCHIKey | WEEGYLXZBRQIMU-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [CHEMBL485259]; PubChem [2758]; |
| Reference of Component-Ingredient Pair | 26795242 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1000 | Foeniculum vulgare | Hui Xiang | 茴香 |
| TCMH1063 | Curcuma longa | Jiang Huang | 姜黄 |
| TCMH108 | Perilla frutescens | Bai Su Zi | 白苏子 |
| TCMH1158 | Ocimum basilicum | Jiu Ceng Ta | 九层塔 |
| TCMH1181 | Chrysanthemum morifolium | Ju Hua | 菊花 |
| TCMH12 | Artemisia argyi | Ai Ye | 艾叶 |
| TCMH1215 | Sophora flavescens | Ku Shen | 苦参 |
| TCMH1225 | Valeriana officinalis | Kuan Ye Xie Cao | 宽叶缬草 |
| TCMH1277 | Alpinia officinarum | Liang Jiang | 良姜 |
| TCMH1290 | Ocimum basilicum | Ling Ling Xiang | 零陵香 |
Showing 1 to 10 of 109 entries
Properties
| Ingredient ID | Formulae | Name | MW | AlogP | MlogP | XlogP | # HBA | # HBD | PSA | # Rotatable Bond | # Ring | # Heacy Atom | Lipinski RO5 Violation |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TCMC1157 | C10H18O | Eucalyptol | 154.14 | 1.3109 | 2.45 | 2.595 | 1 | 0 | 9.23 | 3 | 0 | 11 | 0 |
| TCMC124 | C19H22O7 | (5E)-7-Oxozeaenol | 362.14 | -0.6541 | 2.78 | 2.234 | 5 | 3 | 113.29 | 6 | 2 | 26 | 0 |
| TCMC170 | C10H14O | (S)(+)Carvone | 150.1 | 1.5954 | 2.45 | 1.756 | 1 | 0 | 17.07 | 3 | 1 | 11 | 0 |
| TCMC2142 | C19H28O2 | Testosterone | 288.21 | 0.2615 | 3.33 | 3.635 | 2 | 1 | 37.3 | 3 | 4 | 21 | 0 |
| TCMC3095 | C8H12N2 | Chuanxiongzine | 136.1000484 | 1.758 | 2.12 | 1.992 | 2 | 0 | 25.78 | 0 | 1 | 10 | 0 |
| TCMC3321 | C10H16 | D-Camphene | 136.1252005 | 1.3875 | 2.56 | 4.024 | 0 | 0 | 0 | 0 | 2 | 10 | 0 |
| TCMC42 | C19H16O4 | (1E,4Z,6E)-5-Hydroxy-1,7-Bis(4-Hydroxyphenyl)Hepta-1,4,6-Trien-3-One | 308.1 | -0.5575 | 3.11 | 4.265 | 2 | 3 | 77.76 | 8 | 2 | 23 | 0 |
| TCMC43 | C21H20O6 | (1E,6E)-1,7-Bis(4-Hydroxy-3-Methoxyphenyl)Hepta-1,6-Diene-3,5-Dione | 368.13 | -0.7948 | 3.11 | 2.847 | 2 | 2 | 93.06 | 12 | 2 | 27 | 0 |
| TCMC4416 | C10H16O | Camphor | 152.1201151 | 0.9693 | 2.45 | 2.127 | 1 | 0 | 17.07 | 0 | 2 | 11 | 0 |
| TCMC473 | C10H16O | 4,7,7-Trimethylbicyclo[2.2.1]Heptan-3-One | 152.12 | 0.9693 | 2.45 | 2.127 | 1 | 0 | 17.07 | 3 | 2 | 11 | 0 |
Showing 1 to 10 of 16 entries
Download Data
All data can be downloaded by:→ Selecting data type in the below download table
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