Description of the Component
Component ID |
TCMH1870 |
Latin Name |
Belamcanda chinensis |
English Name |
Blackberrylily |
Chinese Pinyin Name |
She Gan |
中文名 |
射干 |
TCM Properties |
Cold,Bitter |
TCM Meridians |
Lung |
Therapeutic Class English |
Heat clearence |
Therapeutic Class Chinese |
清热 |
Functions |
remove toxic heat, eliminate phlegm, and soothe the sore throat |
Toxicity |
NA |
Geo-authentic habitats (道地产区) |
Hubei Province |
Reference |
Chinese Pharmacopoeia (2015) |
Barcode ID |
|
Barcode Source |
TCM Prescriptions with the Component
| Prescription ID | Prescription English Name | Prescription Chinese Name |
|---|---|---|
| TCMF1089 | Qing Ge Pills | 清膈丸 |
| TCMF1413 | Lusika Pills | 鹭鸶咯丸 |
| TCMF2148 | Belamcanda Ephedra Decoction | 射干麻黄汤 |
| TCMF2327 | Pill Likes Manna for Detoxification, Sweet Dew Poison Eliminating Pill | 甘露消毒丹 |
| TCMF2565 | Lusika Pills | 鹭鸶咯丸 |
| TCMF3520 | Gan Lu Xiao Du Pills | 甘露消毒丸 |
| TCMF401 | Gan Ju Bing Mei Tablet | 甘桔冰梅片 |
| TCMF402 | Gan Lu Xiao Du Pills | 甘露消毒丸 |
| TCMF4226 | Han Chuan Pills | 寒喘丸 |
| TCMF4339 | Jing Zhi Ke Sou Tan Chuan Pills | 京制咳嗽痰喘丸 |
Showing 1 to 10 of 47 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 |
| TCMT11 | HIF1A | Hypoxia-inducible factor 1 alpha | Transcription factor | Q16665 |
| TCMT126 | TERT | Telomerase reverse transcriptase | Transferase | O14746 |
| 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 |
Showing 1 to 10 of 41 entries
Targeted Pathogenic Microbes by the Ingredient of Component
| Target ID | Target Name |
|---|---|
| TCMT1099 | Neuraminidase |
| TCMT1170 | Enterobacter cloacae |
| TCMT1176 | Streptococcus pneumoniae |
| TCMT1178 | Actinomyces viscosus |
| TCMT1182 | Streptococcus sanguinis |
| TCMT1213 | Neisseria gonorrhoeae |
| TCMT1218 | Staphylococcus aureus |
| TCMT1229 | Enterococcus faecalis |
| TCMT1246 | Escherichia coli |
| TCMT1251 | Candida albicans |
Showing 1 to 10 of 14 entries
Ingredient Structrues
Ingredient ID: TCMC7287
Formula: C32H32O16
Ingredient ID: TCMC7287
| Common Name | Shegansu A |
| IUPAC Name | [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[7-hydroxy-3-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-4-oxochromen-5-yl]oxyoxan-2-yl]methyl 4-hydroxy-3-methoxybenzoate |
| Canonical SMILES | COc1cc(cc(c1OC)O)c1coc2c(c1=O)c(O[C@@H]1O[C@H](COC(=O)c3ccc(c(c3)OC)O)[C@H]([C@@H]([C@H]1O)O)O)c(c(c2)O)OC |
| Standard InCHI | InChI=1S/C32H32O16/c1-41-19-8-13(5-6-16(19)33)31(40)46-12-22-25(37)26(38)27(39)32(47-22)48-30-23-20(10-18(35)29(30)44-4)45-11-15(24(23)36)14-7-17(34)28(43-3)21(9-14)42-2/h5-11,22,25-27,32-35,37-39H,12H2,1-4H3/t22-,25-,26+,27-,32+/m1/s1 |
| Standard InCHIKey | CBNMKDFQTQLJHV-VZKRFDLJSA-N |
| External Identifiers | ChEMBL [N/A]; PubChem [102274769]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC6671
Formula: C16H12O7
Ingredient ID: TCMC6671
| Common Name | 5,6,7,4'-Tetrahydroxy-8-Methoxyisoflavone |
| IUPAC Name | 5,6,7-trihydroxy-3-(4-hydroxyphenyl)-8-methoxychromen-4-one |
| Canonical SMILES | COc1c(O)c(O)c(c2c1occ(c2=O)c1ccc(cc1)O)O |
| Standard InCHI | InChI=1S/C16H12O7/c1-22-16-14(21)13(20)12(19)10-11(18)9(6-23-15(10)16)7-2-4-8(17)5-3-7/h2-6,17,19-21H,1H3 |
| Standard InCHIKey | NHKRWDZHHWTCAH-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [N/A]; PubChem [44257374]; |
| Reference of Component-Ingredient Pair | US2009221690 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC5593
Formula: C32H32O16
Ingredient ID: TCMC5593
| Common Name | 6'-O-Vanilloyliridin |
| IUPAC Name | [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-3-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-4-oxochromen-7-yl]oxyoxan-2-yl]methyl 4-hydroxy-3-methoxybenzoate |
| Canonical SMILES | COc1cc(cc(c1OC)O)c1coc2c(c1=O)c(O)c(c(c2)O[C@@H]1O[C@H](COC(=O)c2ccc(c(c2)OC)O)[C@H]([C@@H]([C@H]1O)O)O)OC |
| Standard InCHI | InChI=1S/C32H32O16/c1-41-18-8-13(5-6-16(18)33)31(40)46-12-22-25(36)27(38)28(39)32(48-22)47-21-10-19-23(26(37)30(21)44-4)24(35)15(11-45-19)14-7-17(34)29(43-3)20(9-14)42-2/h5-11,22,25,27-28,32-34,36-39H,12H2,1-4H3/t22-,25-,27+,28-,32-/m1/s1 |
| Standard InCHIKey | QJIJXRYWRDSFAA-ZPWUYAKLSA-N |
| External Identifiers | ChEMBL [N/A]; PubChem [11115062]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC5522
Formula: C31H30O15
Ingredient ID: TCMC5522
| Common Name | 6'-O-P-Hydroxybenzoyliridin |
| IUPAC Name | [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-3-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-4-oxochromen-7-yl]oxyoxan-2-yl]methyl 4-hydroxybenzoate |
| Canonical SMILES | COc1c(O[C@@H]2O[C@H](COC(=O)c3ccc(cc3)O)[C@H]([C@@H]([C@H]2O)O)O)cc2c(c1O)c(=O)c(co2)c1cc(O)c(c(c1)OC)OC |
| Standard InCHI | InChI=1S/C31H30O15/c1-40-19-9-14(8-17(33)28(19)41-2)16-11-43-18-10-20(29(42-3)25(36)22(18)23(16)34)45-31-27(38)26(37)24(35)21(46-31)12-44-30(39)13-4-6-15(32)7-5-13/h4-11,21,24,26-27,31-33,35-38H,12H2,1-3H3/t21-,24-,26+,27-,31-/m1/s1 |
| Standard InCHIKey | AQARCOFZFRLNNY-LLFHEIDASA-N |
| External Identifiers | ChEMBL [N/A]; PubChem [10897544]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC5453
Formula: C30H26O8
Ingredient ID: TCMC5453
| Common Name | Parvifolol D |
| IUPAC Name | 5-[(E)-2-[(2S,3S)-3-(3,5-dihydroxyphenyl)-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]ethenyl]benzene-1,3-diol |
| Canonical SMILES | COc1cc(/C=C/c2cc(O)cc(c2)O)cc2c1O[C@@H]([C@H]2c1cc(O)cc(c1)O)c1ccc(c(c1)OC)O |
| Standard InCHI | InChI=1S/C30H26O8/c1-36-26-13-18(5-6-25(26)35)29-28(19-11-22(33)15-23(34)12-19)24-9-17(10-27(37-2)30(24)38-29)4-3-16-7-20(31)14-21(32)8-16/h3-15,28-29,31-35H,1-2H3/b4-3+/t28-,29+/m0/s1 |
| Standard InCHIKey | JZRNLEJUOUYRLZ-ZEALOZJZSA-N |
| External Identifiers | ChEMBL [N/A]; PubChem [10601899]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC5442
Formula: C16H12O7
Ingredient ID: TCMC5442
| Common Name | 5,6,7,3'-Tetrahydroxy-4'-Methoxyisoflavone |
| IUPAC Name | 5,6,7-trihydroxy-3-(3-hydroxy-4-methoxyphenyl)chromen-4-one |
| Canonical SMILES | COc1ccc(cc1O)c1coc2c(c1=O)c(O)c(c(c2)O)O |
| Standard InCHI | InChI=1S/C16H12O7/c1-22-11-3-2-7(4-9(11)17)8-6-23-12-5-10(18)15(20)16(21)13(12)14(8)19/h2-6,17-18,20-21H,1H3 |
| Standard InCHIKey | UTMSPYXAMXSXRW-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [N/A]; PubChem [10543410]; |
| Reference of Component-Ingredient Pair | 20096370 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC5384
Formula: C22H36O2
Ingredient ID: TCMC5384
| Common Name | Belamcandol B |
| IUPAC Name | 3-methoxy-5-[(E)-pentadec-10-enyl]phenol |
| Canonical SMILES | CCCC/C=C/CCCCCCCCCc1cc(O)cc(c1)OC |
| Standard InCHI | InChI=1S/C22H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-17-21(23)19-22(18-20)24-2/h6-7,17-19,23H,3-5,8-16H2,1-2H3/b7-6+ |
| Standard InCHIKey | NKOPRUNFJQCUCF-VOTSOKGWSA-N |
| External Identifiers | ChEMBL [N/A]; PubChem [10382131]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC5105
Formula: C30H46O5
Ingredient ID: TCMC5105
| Common Name | 28-Deacetylbelamcandal |
| IUPAC Name | (2Z)-2-[(3S,4R,5S,6R,10S)-4,10-dihydroxy-3-[(2E,4E)-1-hydroxy-10-methyl-6-methylideneundeca-2,4,9-trien-2-yl]-6-(3-hydroxypropyl)-10-methylspiro[4.5]decan-7-ylidene]propanal |
| Canonical SMILES | OCCC[C@@H]1/C(=C(C=O)/C)/CC[C@]([C@]21CC[C@H]([C@H]2O)/C(=CC=CC(=C)CCC=C(C)C)/CO)(C)O |
| Standard InCHI | InChI=1S/C30H46O5/c1-21(2)9-6-10-22(3)11-7-12-24(20-33)26-15-17-30(28(26)34)27(13-8-18-31)25(23(4)19-32)14-16-29(30,5)35/h7,9,11-12,19,26-28,31,33-35H,3,6,8,10,13-18,20H2,1-2,4-5H3/b11-7+,24-12-,25-23-/t26-,27+,28+,29-,30-/m0/s1 |
| Standard InCHIKey | XVFORSWJIMCHND-ADWNQYOQSA-N |
| External Identifiers | ChEMBL [N/A]; PubChem [6440311]; |
| Reference of Component-Ingredient Pair | 10075762 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC5061
Formula: C32H48O6
Ingredient ID: TCMC5061
| Common Name | Belamcandal |
| IUPAC Name | [(2E,4E)-2-[(3S,4S,5S,6R,7Z,10S)-4,10-dihydroxy-6-(3-hydroxypropyl)-10-methyl-7-(1-oxopropan-2-ylidene)spiro[4.5]decan-3-yl]-10-methyl-6-methylideneundeca-2,4,9-trienyl] acetate |
| Canonical SMILES | OCCC[C@@H]1/C(=C(C=O)/C)/CC[C@]([C@]21CC[C@H]([C@@H]2O)/C(=CC=CC(=C)CCC=C(C)C)/COC(=O)C)(C)O |
| Standard InCHI | InChI=1S/C32H48O6/c1-22(2)10-7-11-23(3)12-8-13-26(21-38-25(5)35)28-16-18-32(30(28)36)29(14-9-19-33)27(24(4)20-34)15-17-31(32,6)37/h8,10,12-13,20,28-30,33,36-37H,3,7,9,11,14-19,21H2,1-2,4-6H3/b12-8+,26-13-,27-24-/t28-,29+,30-,31-,32-/m0/s1 |
| Standard InCHIKey | PCXCPWDHJKSSOL-FYWQJHIMSA-N |
| External Identifiers | ChEMBL [N/A]; PubChem [6398574]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC5010
Formula: C17H14O7
Ingredient ID: TCMC5010
| Common Name | Iristectorigenin A |
| IUPAC Name | 5,7-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)-6-methoxychromen-4-one |
| Canonical SMILES | COc1ccc(cc1O)c1coc2c(c1=O)c(O)c(c(c2)O)OC |
| Standard InCHI | InChI=1S/C17H14O7/c1-22-12-4-3-8(5-10(12)18)9-7-24-13-6-11(19)17(23-2)16(21)14(13)15(9)20/h3-7,18-19,21H,1-2H3 |
| Standard InCHIKey | WRZOUWHPDDOJNR-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [CHEMBL486825]; PubChem [5488781]; |
| Reference of Component-Ingredient Pair | N/A |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC4991
Formula: C18H16O8
Ingredient ID: TCMC4991
| Common Name | Irigenin |
| IUPAC Name | 5,7-dihydroxy-3-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxychromen-4-one |
| Canonical SMILES | COc1cc(cc(c1OC)O)c1coc2c(c1=O)c(O)c(c(c2)O)OC |
| Standard InCHI | InChI=1S/C18H16O8/c1-23-13-5-8(4-10(19)17(13)24-2)9-7-26-12-6-11(20)18(25-3)16(22)14(12)15(9)21/h4-7,19-20,22H,1-3H3 |
| Standard InCHIKey | TUGWPJJTQNLKCL-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [CHEMBL487013]; PubChem [5464170]; |
| Reference of Component-Ingredient Pair | 22627971 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC4891
Formula: C23H38O3
Ingredient ID: TCMC4891
| Common Name | Belamcandol A |
| IUPAC Name | 2,4-dimethoxy-6-[(Z)-pentadec-10-enyl]phenol |
| Canonical SMILES | CCCC/C=CCCCCCCCCCc1cc(OC)cc(c1O)OC |
| Standard InCHI | InChI=1S/C23H38O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-18-21(25-2)19-22(26-3)23(20)24/h7-8,18-19,24H,4-6,9-17H2,1-3H3/b8-7- |
| Standard InCHIKey | GBCXPDPXQWPCTG-FPLPWBNLSA-N |
| External Identifiers | ChEMBL [N/A]; PubChem [5321906]; |
| Reference of Component-Ingredient Pair | 8477510 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC4374
Formula: C16H12O6
Ingredient ID: TCMC4374
| Common Name | Tectorigenin |
| IUPAC Name | 5,7-dihydroxy-3-(4-hydroxyphenyl)-6-methoxychromen-4-one |
| Canonical SMILES | COc1c(O)cc2c(c1O)c(=O)c(co2)c1ccc(cc1)O |
| Standard InCHI | InChI=1S/C16H12O6/c1-21-16-11(18)6-12-13(15(16)20)14(19)10(7-22-12)8-2-4-9(17)5-3-8/h2-7,17-18,20H,1H3 |
| Standard InCHIKey | OBBCRPUNCUPUOS-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [CHEMBL242740]; PubChem [5281811]; |
| Reference of Component-Ingredient Pair | 22627971 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC4373
Formula: C22H22O11
Ingredient ID: TCMC4373
| Common Name | Tectoridin |
| IUPAC Name | 5-hydroxy-3-(4-hydroxyphenyl)-6-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one |
| Canonical SMILES | OC[C@H]1O[C@@H](Oc2cc3occ(c(=O)c3c(c2OC)O)c2ccc(cc2)O)[C@@H]([C@H]([C@@H]1O)O)O |
| Standard InCHI | InChI=1S/C22H22O11/c1-30-21-13(32-22-20(29)19(28)17(26)14(7-23)33-22)6-12-15(18(21)27)16(25)11(8-31-12)9-2-4-10(24)5-3-9/h2-6,8,14,17,19-20,22-24,26-29H,7H2,1H3/t14-,17-,19+,20-,22-/m1/s1 |
| Standard InCHIKey | CNOURESJATUGPN-UDEBZQQRSA-N |
| External Identifiers | ChEMBL [CHEMBL520214]; PubChem [5281810]; |
| Reference of Component-Ingredient Pair | 21137344 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC4364
Formula: C24H26O13
Ingredient ID: TCMC4364
| Common Name | Iridin |
| IUPAC Name | 5-hydroxy-3-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one |
| Canonical SMILES | OC[C@H]1O[C@@H](Oc2cc3occ(c(=O)c3c(c2OC)O)c2cc(O)c(c(c2)OC)OC)[C@@H]([C@H]([C@@H]1O)O)O |
| Standard InCHI | InChI=1S/C24H26O13/c1-32-13-5-9(4-11(26)22(13)33-2)10-8-35-12-6-14(23(34-3)19(29)16(12)17(10)27)36-24-21(31)20(30)18(28)15(7-25)37-24/h4-6,8,15,18,20-21,24-26,28-31H,7H2,1-3H3/t15-,18-,20+,21-,24-/m1/s1 |
| Standard InCHIKey | LNQCUTNLHUQZLR-OZJWLQQPSA-N |
| External Identifiers | ChEMBL [CHEMBL487014]; PubChem [5281777]; |
| Reference of Component-Ingredient Pair | 28069265 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC4351
Formula: C19H18O11
Ingredient ID: TCMC4351
| Common Name | Mangiferin |
| IUPAC Name | 1,3,6,7-tetrahydroxy-2-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]xanthen-9-one |
| Canonical SMILES | OC[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)c1c(O)cc2c(c1O)c(=O)c1c(o2)cc(c(c1)O)O |
| Standard InCHI | InChI=1S/C19H18O11/c20-4-11-15(25)17(27)18(28)19(30-11)12-8(23)3-10-13(16(12)26)14(24)5-1-6(21)7(22)2-9(5)29-10/h1-3,11,15,17-23,25-28H,4H2/t11-,15-,17+,18-,19+/m1/s1 |
| Standard InCHIKey | AEDDIBAIWPIIBD-ZJKJAXBQSA-N |
| External Identifiers | ChEMBL [CHEMBL464825]; PubChem [5281647]; |
| Reference of Component-Ingredient Pair | 22815239 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC3645
Formula: C20H18O8
Ingredient ID: TCMC3645
| Common Name | Irisflorentin |
| IUPAC Name | 9-methoxy-7-(3,4,5-trimethoxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one |
| Canonical SMILES | COc1cc(cc(c1OC)OC)c1coc2c(c1=O)c(OC)c1c(c2)OCO1 |
| Standard InCHI | InChI=1S/C20H18O8/c1-22-13-5-10(6-14(23-2)18(13)24-3)11-8-26-12-7-15-19(28-9-27-15)20(25-4)16(12)17(11)21/h5-8H,9H2,1-4H3 |
| Standard InCHIKey | RISXUTCDCPHJFQ-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [CHEMBL487216]; PubChem [170569]; |
| Reference of Component-Ingredient Pair | 22627971 |
Occurrence of the ingredient across TCM components
Ingredient ID: TCMC2257
Formula: C16H12O6
Ingredient ID: TCMC2257
| Common Name | Rhamnocitrin |
| IUPAC Name | 3,5-dihydroxy-2-(4-hydroxyphenyl)-7-methoxychromen-4-one |
| Canonical SMILES | COc1cc(O)c2c(c1)oc(c(c2=O)O)c1ccc(cc1)O |
| Standard InCHI | InChI=1S/C16H12O6/c1-21-10-6-11(18)13-12(7-10)22-16(15(20)14(13)19)8-2-4-9(17)5-3-8/h2-7,17-18,20H,1H3 |
| Standard InCHIKey | MQSZRBPYXNEFHF-UHFFFAOYSA-N |
| External Identifiers | ChEMBL [CHEMBL442289]; PubChem [5320946]; |
| Reference of Component-Ingredient Pair | 24685503 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1008 | Pogostemon cablin | Huo Xiang | 藿香 |
| TCMH1009 | Pogostemon cablin | Huo Xiang Ye | 藿香叶 |
| TCMH1105 | Trollius chinensis | Jin Lian Hua | 金莲花 |
| TCMH1697 | Iris tectorum | Qing Wa Qi | 青蛙七 |
| TCMH1810 | Semen astragali complanati | Sha Yuan Ji Li | 沙苑蒺藜 |
| TCMH1811 | Semen astragali complanati | Sha Yuan Zi | 沙苑子 |
| TCMH1846 | Artemisia capillaris | Shan Yin Chen | 山茵陈 |
| TCMH1870 | Belamcanda chinensis | She Gan | 射干 |
| TCMH1930 | Umbilicaria esculenta | Shi Er | 石耳 |
| TCMH2121 | Semen astragali complanati | Tong Ji Li | 潼蒺藜 |
Showing 1 to 10 of 37 entries
Ingredient ID: TCMC2003
Formula: C14H12O3
Ingredient ID: TCMC2003
| Common Name | Resveratrol |
| IUPAC Name | 5-[(E)-2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol |
| Canonical SMILES | Oc1ccc(cc1)/C=C/c1cc(O)cc(c1)O |
| Standard InCHI | InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1+ |
| Standard InCHIKey | LUKBXSAWLPMMSZ-OWOJBTEDSA-N |
| External Identifiers | ChEMBL [CHEMBL165]; PubChem [445154]; |
| Reference of Component-Ingredient Pair | 26766292 |
Occurrence of the ingredient across TCM components
| Component ID | Latin Name | Pinyin Name | Chinese Name |
|---|---|---|---|
| TCMH1446 | Vaccinium oxycoccos | Man Yue Mei | 蔓越莓 |
| TCMH1518 | Chaenomeles sinensis | Mu Gua | 木瓜 |
| TCMH1519 | Oroxylum indicum | Mu Hu Die | 木蝴蝶 |
| TCMH1721 | Panax ginseng | Ren Shen | 人参 |
| TCMH1728 | Panax ginseng | Ren Shen Ye | 人参叶 |
| TCMH1792 | Morus alba | Sang Pi | 桑皮 |
| TCMH1797 | Morus alba | Sang Ye | 桑叶 |
| TCMH1798 | Morus alba | Sang Zhi | 桑枝 |
| TCMH1839 | Panax ginseng | Shan Shen | 山参 |
| TCMH1870 | Belamcanda chinensis | She Gan | 射干 |
Showing 1 to 10 of 25 entries
Properties
| Ingredient ID | Formulae | Name | MW | AlogP | MlogP | XlogP | # HBA | # HBD | PSA | # Rotatable Bond | # Ring | # Heacy Atom | Lipinski RO5 Violation |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TCMC2003 | C14H12O3 | Resveratrol | 228.08 | -0.9131 | 2.67 | 3.436 | 0 | 3 | 60.69 | 5 | 2 | 17 | 0 |
| TCMC2257 | C16H12O6 | Rhamnocitrin | 300.06 | -1.9324 | 2.56 | 2.434 | 2 | 3 | 96.22 | 6 | 3 | 22 | 0 |
| TCMC3645 | C20H18O8 | Irisflorentin | 386.1001675 | -0.664 | 2.78 | 1.377 | 1 | 0 | 72.45 | 5 | 4 | 28 | 0 |
| TCMC4351 | C19H18O11 | Mangiferin | 422.0849114 | -4.3024 | 2.34 | -2.313 | 8 | 8 | 188.14 | 2 | 4 | 30 | 1 |
| TCMC4364 | C24H26O13 | Iridin | 522.1373409 | -3.4373 | 2.67 | -1.215 | 6 | 6 | 184.6 | 7 | 4 | 37 | 1 |
| TCMC4373 | C22H22O11 | Tectoridin | 462.1162115 | -3.3337 | 2.67 | -0.327 | 6 | 6 | 166.14 | 5 | 4 | 33 | 1 |
| TCMC4374 | C16H12O6 | Tectorigenin | 300.0633881 | -1.5868 | 2.56 | 0.781 | 1 | 3 | 86.99 | 2 | 3 | 22 | 0 |
| TCMC4891 | C23H38O3 | Belamcandol A | 362.2820951 | -2.0632 | 3.66 | 8.507 | 0 | 1 | 38.69 | 15 | 1 | 26 | 2 |
| TCMC4991 | C18H16O8 | Irigenin | 360.0845175 | -1.6904 | 2.56 | -0.107 | 1 | 3 | 105.45 | 4 | 3 | 26 | 0 |
| TCMC5010 | C17H14O7 | Iristectorigenin A | 330.0739528 | -1.6386 | 2.56 | 0.337 | 1 | 3 | 96.22 | 3 | 3 | 24 | 0 |
Showing 1 to 10 of 19 entries
Download Data
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