TCM-ID Component

Description of the Component

Component ID	TCMH1214
Latin Name	Picrasma quassioides
English Name	Indian quassiawood
Chinese Pinyin Name	Ku Mu
中文名	苦木
TCM Properties
TCM Meridians
Therapeutic Class English
Therapeutic Class Chinese
Functions	act against bacteria and relieve inflammation, remove damp, and counteract toxicity
Toxicity	NA
Geo-authentic habitats (道地产区)	NA
Reference	Chinese Pharmacopoeia (2015)
Barcode ID	ITSAJ4374-14
Barcode Source	BOLDSYSTEMS

TCM Prescriptions with the Component

Prescription ID	Prescription English Name	Prescription Chinese Name
TCMFx3653	Fu Fang Ku Mu Xiao Yan Tablets	复方苦木消炎片
TCMFx3093	Fu Yan Ping Capsules	妇炎平胶囊
TCMFx3101	Fu Yan Ping Powder	妇炎平散
TCMFx4531	Ku Mu Zhu She Oral Liquid	苦木注射液
TCMFx4128	Lian Dan Xiao Yan Tablets	莲胆消炎片
TCMFx1024	Xiao Yan Li Dan Tablet	消炎利胆片
TCMFx6367	Xiao Yan Li Dan Tablets	消炎利胆片

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
TCMT113	OPRD1	Delta opioid receptor	GPCR	P41143
TCMT114	CNR2	Cannabinoid CB2 receptor	GPCR	P34972
TCMT115	CNR1	Cannabinoid CB1 receptor	GPCR	P21554
TCMT116	OPRM1	Mu opioid receptor	GPCR	P35372
TCMT125	GBA	Beta-glucocerebrosidase	Hydrolase	P04062
TCMT13	APEX1	DNA-(apurinic or apyrimidinic site) lyase	Lyase	P27695
TCMT131	ACHE	Acetylcholinesterase	Hydrolase	P22303
TCMT132	BCHE	Butyrylcholinesterase	Hydrolase	P06276
TCMT133	CA1	Carbonic anhydrase I	Lyase	P00915
TCMT134	CA2	Carbonic anhydrase II	Lyase	P00918
TCMT136	CA12	Carbonic anhydrase XII	Lyase	O43570
TCMT137	CA9	Carbonic anhydrase IX	Lyase	Q16790
TCMT150	RORC	Nuclear receptor ROR-gamma	Nuclear receptor	P51449
TCMT158	EPHX2	Epoxide hydratase	Lyase	P34913
TCMT162	UGT1A1	UDP-glucuronosyltransferase 1-1	Transferase	P22309
TCMT17	POLB	DNA polymerase beta	Transferase	P06746
TCMT171	PTPN6	Protein-tyrosine phosphatase 1C	Hydrolase	P29350
TCMT18	GAA	Lysosomal alpha-glucosidase	Hydrolase	P10253
TCMT189	DUSP3	Dual specificity protein phosphatase 3	Hydrolase	P51452
TCMT190	PTPN2	T-cell protein-tyrosine phosphatase	Hydrolase	P17706
TCMT2	MAPT	Microtubule-associated protein tau	Unclassified	P10636
TCMT207	BACE1	Beta-secretase 1	Protease	P56817
TCMT223	AKR1B1	Aldose reductase	Oxidoreductase	P15121
TCMT233	PTPN11	Protein-tyrosine phosphatase 2C	Hydrolase	Q06124
TCMT237	SLC5A1	Sodium/glucose cotransporter 1	Transporter	P13866
TCMT238	SLC5A2	Sodium/glucose cotransporter 2	Transporter	P31639
TCMT239	PIM1	Serine/threonine-protein kinase PIM1	Kinase	P11309
TCMT248	CXCL8	Interleukin-8	Unclassified	P10145
TCMT3	ALOX15	Arachidonate 15-lipoxygenase	Oxidoreductase	P16050
TCMT31	CYP2C19	Cytochrome P450 2C19	Oxidoreductase	P33261
TCMT33	CYP3A4	Cytochrome P450 3A4	Oxidoreductase	P08684
TCMT336	IDO1	Indoleamine 2,3-dioxygenase	Oxidoreductase	P14902
TCMT34	CYP2D6	Cytochrome P450 2D6	Oxidoreductase	P10635
TCMT45	APP	Beta amyloid A4 protein	Unclassified	P05067
TCMT510	KIT	Stem cell growth factor receptor	Kinase	P10721
TCMT629	ABCC1	Multidrug resistance-associated protein 1	Transporter	P33527
TCMT69	THRB	Thyroid hormone receptor beta-1	Nuclear receptor	P10828
TCMT747	ABCG2	ATP-binding cassette sub-family G member 2	Transporter	Q9UNQ0
TCMT752	CSNK2A1	Casein kinase II alpha	Kinase	P68400
TCMT8	KDM4E	Lysine-specific demethylase 4D-like	Oxidoreductase	B2RXH2
TCMT80	MAPK1	MAP kinase ERK2	Kinase	P28482
TCMT82	ESR1	Estrogen receptor alpha	Nuclear receptor	P03372
TCMT87	CYP2C9	Cytochrome P450 2C9	Oxidoreductase	P11712

Targeted Pathogenic Microbes by the Ingredient of Component

Target ID	Target Name
TCMT1099	Neuraminidase
TCMT1176	Streptococcus pneumoniae
TCMT1181	Mycobacterium tuberculosis H37Ra
TCMT1212	Verticillium dahliae
TCMT1218	Staphylococcus aureus
TCMT1229	Enterococcus faecalis
TCMT1286	Bacillus cereus
TCMT1438	Plasmodium falciparum
TCMT1454	Bacillus subtilis
TCMT1455	Mycobacterium tuberculosis H37Rv
TCMT1458	Filobasidiella neoformans
TCMT1465	Entamoeba histolytica

Ingredient Structrues

Ingredient ID: TCMC865
Formula: C14H8N2O

Common Name	Canthin-6-One
IUPAC Name	n.a.
Canonical SMILES	O=c1ccc2c3n1c1ccccc1c3ccn2
Standard InCHI	InChI=1S/C14H8N2O/c17-13-6-5-11-14-10(7-8-15-11)9-3-1-2-4-12(9)16(13)14/h1-8H
Standard InCHIKey	ZERVJPYNQLONEK-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL156897]; PubChem [97176];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木
TCMH316	Ailanthi cortex	Chun Pi	椿皮
TCMH2374	Phellodendron amurense	Yan Guan Huang Bai	盐关黄柏
TCMH2360	Brucea javanica	Ya Dan Zi	鸦胆子
TCMH970	Vitex negundo	Huang Jing Zi	黄荆子
TCMH314	Ailanthus altissima	Chun Gen Pi	椿根皮
TCMH717	Phellodendron amurense	Guan Huang Bai	关黄柏
TCMH949	Phellodendron amurense	Huang Bai	黄柏
TCMH950	Phellodendron amurense	Huang Bai Fen	黄柏粉
TCMH951	Phellodendron amurense	Huang Bai Tan	黄柏炭

Ingredient ID: TCMC6590
Formula: C22H28O6

Common Name	Picrasmin
IUPAC Name	(1S,2S,6S,7S,9R,13S,17S)-4,15-dimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,14-diene-3,11,16-trione
Canonical SMILES	COC1=C[C@@H](C)[C@H]2[C@@](C1=O)(C)[C@H]1C(=O)C(=C([C@@H]3[C@@]1([C@@H](C2)OC(=O)C3)C)C)OC
Standard InCHI	InChI=1S/C22H28O6/c1-10-7-14(26-5)20(25)22(4)12(10)8-15-21(3)13(9-16(23)28-15)11(2)18(27-6)17(24)19(21)22/h7,10,12-13,15,19H,8-9H2,1-6H3/t10-,12+,13-,15-,19+,21-,22+/m1/s1
Standard InCHIKey	IOSXSVZRTUWBHC-NYWUXZQNSA-N
External Identifiers	ChEMBL [N/A]; PubChem [23624185];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木

Ingredient ID: TCMC5933
Formula: C21H28O6

Common Name	Nigakilactone I
IUPAC Name	(1S,2S,4S,6R,7S,9R,13R,17S)-4-hydroxy-15-methoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-14-ene-3,11,16-trione
Canonical SMILES	COC1=C(C)[C@@H]2CC(=O)O[C@H]3[C@@]2([C@H](C1=O)[C@]1(C)[C@@H](C3)[C@H](C)C[C@@H](C1=O)O)C
Standard InCHI	InChI=1S/C21H28O6/c1-9-6-13(22)19(25)21(4)11(9)7-14-20(3)12(8-15(23)27-14)10(2)17(26-5)16(24)18(20)21/h9,11-14,18,22H,6-8H2,1-5H3/t9-,11+,12+,13+,14-,18+,20-,21+/m1/s1
Standard InCHIKey	GESOKLRVLMVNMO-WCAPFRRUSA-N
External Identifiers	ChEMBL [N/A]; PubChem [12313355];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木

Ingredient ID: TCMC579
Formula: C7H14O6

Common Name	6-Methoxycyclohexane-1,2,3,4,5-Pentol
IUPAC Name	6-methoxycyclohexane-1,2,3,4,5-pentol
Canonical SMILES	COC1C(O)C(O)C(C(C1O)O)O
Standard InCHI	InChI=1S/C7H14O6/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h2-12H,1H3
Standard InCHIKey	DSCFFEYYQKSRSV-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL171890]; PubChem [230881];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木
TCMH985	Astragalus membranaceus	Huang Qi Ti Qu Ye	黄芪提取液
TCMH314	Ailanthus altissima	Chun Gen Pi	椿根皮
TCMH13	Artemisia argyi	Ai Ye You	艾叶油
TCMH981	Astragalus membranaceus	Huang Qi	黄芪
TCMH983	Astragalus membranaceus	Huang Qi Gan Jin Gao	黄芪干浸膏
TCMH984	Astragalus membranaceus	Huang Qi Jin Gao	黄芪浸膏
TCMH12	Artemisia argyi	Ai Ye	艾叶

Ingredient ID: TCMC559
Formula: C15H10N2O2

Common Name	5-Methoxycanthinone
IUPAC Name	n.a.
Canonical SMILES	COc1cc2nccc3c2n(c1=O)c1ccccc31
Standard InCHI	InChI=1S/C15H10N2O2/c1-19-13-8-11-14-10(6-7-16-11)9-4-2-3-5-12(9)17(14)15(13)18/h2-8H,1H3
Standard InCHIKey	TXEFUSAHPIYZHD-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL508649]; PubChem [259218];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木
TCMH316	Ailanthi cortex	Chun Pi	椿皮
TCMH2360	Brucea javanica	Ya Dan Zi	鸦胆子
TCMH970	Vitex negundo	Huang Jing Zi	黄荆子

Ingredient ID: TCMC5417
Formula: C21H30O6

Common Name	Nigakilactone A
IUPAC Name	(1S,2S,6S,7S,9R,13S,14R,15S,16S,17S)-15,16-dihydroxy-4-methoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-ene-3,11-dione
Canonical SMILES	COC1=C[C@@H](C)[C@H]2[C@@](C1=O)(C)[C@H]1[C@H](O)[C@@H](O)[C@@H]([C@H]3[C@@]1([C@@H](C2)OC(=O)C3)C)C
Standard InCHI	InChI=1S/C21H30O6/c1-9-6-13(26-5)19(25)21(4)11(9)7-14-20(3)12(8-15(22)27-14)10(2)16(23)17(24)18(20)21/h6,9-12,14,16-18,23-24H,7-8H2,1-5H3/t9-,10-,11+,12+,14-,16+,17-,18+,20-,21+/m1/s1
Standard InCHIKey	ZIVURVYGGHVTQO-CUCOLZSJSA-N
External Identifiers	ChEMBL [N/A]; PubChem [10452259];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木

Ingredient ID: TCMC4807
Formula: C22H30O6

Common Name	Neoquassin
IUPAC Name	(1S,2S,6S,7S,9R,11S,13R,17S)-11-hydroxy-4,15-dimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,14-diene-3,16-dione
Canonical SMILES	COC1=C[C@@H](C)[C@H]2[C@@](C1=O)(C)[C@H]1C(=O)C(=C([C@H]3[C@@]1([C@@H](C2)O[C@@H](C3)O)C)C)OC
Standard InCHI	InChI=1S/C22H30O6/c1-10-7-14(26-5)20(25)22(4)12(10)8-15-21(3)13(9-16(23)28-15)11(2)18(27-6)17(24)19(21)22/h7,10,12-13,15-16,19,23H,8-9H2,1-6H3/t10-,12+,13+,15-,16+,19+,21-,22+/m1/s1
Standard InCHIKey	BDQNCUODBJZKIY-XESZMDDISA-N
External Identifiers	ChEMBL [N/A]; PubChem [5320109];
Reference of Component-Ingredient Pair	12737395

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木

Ingredient ID: TCMC470
Formula: C16H12N2O3

Common Name	4,5-Dimethoxycanthin-6-One
IUPAC Name	n.a.
Canonical SMILES	COc1c(OC)c2nccc3c2n(c1=O)c1ccccc31
Standard InCHI	InChI=1S/C16H12N2O3/c1-20-14-12-13-10(7-8-17-12)9-5-3-4-6-11(9)18(13)16(19)15(14)21-2/h3-8H,1-2H3
Standard InCHIKey	ATONBUGCNDSBBC-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL2386324]; PubChem [638215];
Reference of Component-Ingredient Pair	28962866

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木
TCMH32	Alangium chinense	Ba Jiao Feng	八角枫
TCMH970	Vitex negundo	Huang Jing Zi	黄荆子

Ingredient ID: TCMC4684
Formula: C15H14N2O2

Common Name	Kumujian G
IUPAC Name	1-ethenyl-4,8-dimethoxy-9H-pyrido[3,4-b]indole
Canonical SMILES	COc1cccc2c1[nH]c1c2c(OC)cnc1C=C
Standard InCHI	InChI=1S/C15H14N2O2/c1-4-10-15-13(12(19-3)8-16-10)9-6-5-7-11(18-2)14(9)17-15/h4-8,17H,1H2,2-3H3
Standard InCHIKey	LDWBTKDUAXOZRB-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL3400675]; PubChem [5318875];
Reference of Component-Ingredient Pair	29725985

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木

Ingredient ID: TCMC4562
Formula: C13H10N2O2

Common Name	1-Formyl-4-Methoxy-Β-Carboline
IUPAC Name	4-methoxy-9H-pyrido[3,4-b]indole-1-carbaldehyde
Canonical SMILES	O=Cc1ncc(c2c1[nH]c1c2cccc1)OC
Standard InCHI	InChI=1S/C13H10N2O2/c1-17-11-6-14-10(7-16)13-12(11)8-4-2-3-5-9(8)15-13/h2-7,15H,1H3
Standard InCHIKey	NHVDRRXZBKLFSV-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [5317378];
Reference of Component-Ingredient Pair	29725985

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木

Ingredient ID: TCMC3691
Formula: C26H34O8

Common Name	Nigakilactone G
IUPAC Name	(1S,2S,6S,7S,9R,13R,14R,16R,17S)-16-hydroxy-4-methoxy-2,6,14,17-tetramethyl-14-[(3R)-5-oxooxolane-3-carbonyl]-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-ene-3,11-dione
Canonical SMILES	COC1=C[C@@H](C)[C@H]2[C@@](C1=O)(C)[C@H]1[C@H](O)C[C@@]([C@H]3[C@@]1([C@@H](C2)OC(=O)C3)C)(C)C(=O)[C@H]1COC(=O)C1
Standard InCHI	InChI=1S/C26H34O8/c1-12-6-16(32-5)23(31)25(3)14(12)8-18-26(4)17(9-20(29)34-18)24(2,10-15(27)21(25)26)22(30)13-7-19(28)33-11-13/h6,12-15,17-18,21,27H,7-11H2,1-5H3/t12-,13-,14+,15-,17+,18-,21-,24-,25+,26-/m1/s1
Standard InCHIKey	BIJFTRIMTHYJOV-QRWZCSJESA-N
External Identifiers	ChEMBL [N/A]; PubChem [185611];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木

Ingredient ID: TCMC3690
Formula: C24H34O7

Common Name	Nigakilactone C
IUPAC Name	[(1S,2S,6S,7S,9R,13S,14R,15S,16S,17S)-4,15-dimethoxy-2,6,14,17-tetramethyl-3,11-dioxo-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-en-16-yl] acetate
Canonical SMILES	CO[C@H]1[C@H](C)[C@@H]2CC(=O)O[C@H]3[C@@]2([C@H]([C@@H]1OC(=O)C)[C@]1(C)[C@@H](C3)[C@H](C)C=C(C1=O)OC)C
Standard InCHI	InChI=1S/C24H34O7/c1-11-8-16(28-6)22(27)24(5)14(11)9-17-23(4)15(10-18(26)31-17)12(2)19(29-7)20(21(23)24)30-13(3)25/h8,11-12,14-15,17,19-21H,9-10H2,1-7H3/t11-,12-,14+,15+,17-,19+,20-,21+,23-,24+/m1/s1
Standard InCHIKey	JFFUKRBVELYCPJ-FIKFPIMESA-N
External Identifiers	ChEMBL [N/A]; PubChem [185556];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木

Ingredient ID: TCMC3681
Formula: C23H34O7

Common Name	Nigakilactone J
IUPAC Name	[(1S,2S,4S,6R,7S,9R,13S,14R,15S,16S,17S)-4-hydroxy-15-methoxy-2,6,14,17-tetramethyl-3,11-dioxo-10-oxatetracyclo[7.7.1.02,7.013,17]heptadecan-16-yl] acetate
Canonical SMILES	CO[C@H]1[C@H](C)[C@@H]2CC(=O)O[C@H]3[C@@]2([C@H]([C@@H]1OC(=O)C)[C@]1(C)[C@@H](C3)[C@H](C)C[C@@H](C1=O)O)C
Standard InCHI	InChI=1S/C23H34O7/c1-10-7-15(25)21(27)23(5)13(10)8-16-22(4)14(9-17(26)30-16)11(2)18(28-6)19(20(22)23)29-12(3)24/h10-11,13-16,18-20,25H,7-9H2,1-6H3/t10-,11-,13+,14+,15+,16-,18+,19-,20+,22-,23+/m1/s1
Standard InCHIKey	XTAVFXFXCFHNNF-SEMNJSAISA-N
External Identifiers	ChEMBL [N/A]; PubChem [182145];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木

Ingredient ID: TCMC281
Formula: C13H10N2O2

Common Name	1-Methoxycarbonyl-Beta-Carboline
IUPAC Name	methyl 9H-pyrido[3,4-b]indole-1-carboxylate
Canonical SMILES	COC(=O)c1nccc2c1[nH]c1c2cccc1
Standard InCHI	InChI=1S/C13H10N2O2/c1-17-13(16)12-11-9(6-7-14-12)8-4-2-3-5-10(8)15-11/h2-7,15H,1H3
Standard InCHIKey	FRNCTTUBAHKEBZ-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL2229719]; PubChem [597266];
Reference of Component-Ingredient Pair	22043251

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木
TCMH2556	Polygala tenuifolia	Yuan Zhi Liu Jin Gao	远志流浸膏
TCMH970	Vitex negundo	Huang Jing Zi	黄荆子
TCMH2554	Polygala tenuifolia	Yuan Zhi	远志
TCMH2555	Polygala tenuifolia	Yuan Zhi Jin Gao	远志浸膏

Ingredient ID: TCMC272
Formula: C13H10N2O

Common Name	1-Acetyl-Beta-Carboline
IUPAC Name	1-(9H-pyrido[3,4-b]indol-1-yl)ethanone
Canonical SMILES	CC(=O)c1nccc2c1[nH]c1c2cccc1
Standard InCHI	InChI=1S/C13H10N2O/c1-8(16)12-13-10(6-7-14-12)9-4-2-3-5-11(9)15-13/h2-7,15H,1H3
Standard InCHIKey	NXZSUJKPVSDFNF-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL1682931]; PubChem [638667];
Reference of Component-Ingredient Pair	20046738

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木
TCMH316	Ailanthi cortex	Chun Pi	椿皮
TCMH494	Cordyceps sinensis	Dong Chong Xia Cao	冬虫夏草

Ingredient ID: TCMC2603
Formula: C7H8O2

Common Name	Methylhydroquinone
IUPAC Name	2-methylbenzene-1,4-diol
Canonical SMILES	Oc1ccc(c(c1)C)O
Standard InCHI	InChI=1S/C7H8O2/c1-5-4-6(8)2-3-7(5)9/h2-4,8-9H,1H3
Standard InCHIKey	CNHDIAIOKMXOLK-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL450917]; PubChem [7253];
Reference of Component-Ingredient Pair	19662873

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木
TCMH1839	Panax ginseng	Shan Shen	山参
TCMH1359	Pyrola calliantha	Lu Xian Cao	鹿衔草
TCMH1721	Panax ginseng	Ren Shen	人参
TCMH1728	Panax ginseng	Ren Shen Ye	人参叶

Ingredient ID: TCMC2536
Formula: C15H10N2O3

Common Name	Picrasidine Q
IUPAC Name	n.a.
Canonical SMILES	COc1c(O)c2nccc3c2n(c1=O)c1ccccc31
Standard InCHI	InChI=1S/C15H10N2O3/c1-20-14-13(18)11-12-9(6-7-16-11)8-4-2-3-5-10(8)17(12)15(14)19/h2-7,18H,1H3
Standard InCHIKey	HJFNTSGIQCFHGP-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL2229716]; PubChem [54714262];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木
TCMH2360	Brucea javanica	Ya Dan Zi	鸦胆子
TCMH970	Vitex negundo	Huang Jing Zi	黄荆子

Ingredient ID: TCMC2375
Formula: C22H28O6

Common Name	Quassin
IUPAC Name	n.a.
Canonical SMILES	COC1=C[C@@H](C)[C@H]2[C@@](C1=O)(C)[C@H]1C(=O)C(=C([C@H]3[C@@]1([C@@H](C2)OC(=O)C3)C)C)OC
Standard InCHI	InChI=1S/C22H28O6/c1-10-7-14(26-5)20(25)22(4)12(10)8-15-21(3)13(9-16(23)28-15)11(2)18(27-6)17(24)19(21)22/h7,10,12-13,15,19H,8-9H2,1-6H3/t10-,12+,13+,15-,19+,21-,22+/m1/s1
Standard InCHIKey	IOSXSVZRTUWBHC-LBTVDEKVSA-N
External Identifiers	ChEMBL [CHEMBL517016]; PubChem [65571];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木

Ingredient ID: TCMC2204
Formula: C9H6O3

Common Name	Umbelliferone
IUPAC Name	7-hydroxychromen-2-one
Canonical SMILES	Oc1ccc2c(c1)oc(=O)cc2
Standard InCHI	InChI=1S/C9H6O3/c10-7-3-1-6-2-4-9(11)12-8(6)5-7/h1-5,10H
Standard InCHIKey	ORHBXUUXSCNDEV-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL51628]; PubChem [5281426];
Reference of Component-Ingredient Pair	24685503

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1895	Rhodiola sacra	Sheng Di Hong Jing Tian	圣地红景天
TCMH211	Atractylodes lancea	Cang Zhu	苍术
TCMH457	Euphorbia humifusa	Di Mian Cao	地绵草
TCMH1214	Picrasma quassioides	Ku Mu	苦木
TCMH2630	Citrus aurantium	Zhi Shi	枳实
TCMH1656	Angelica decursiva	Qian Hu	前胡
TCMH2495	Artemisia capillaris	Yin Chen Hao Gan Jin Gao	茵陈蒿干浸膏
TCMH266	Clerodendrum bungei	Chu Mu Dan	臭牡丹
TCMH2143	Sophora flavescens	Tu Ku Shen	土苦参
TCMH2513	Rhododendron mucronulatum	Ying Shan Hong	映山红
TCMH120	Atractylodes macrocephala	Bai Zhu	白术
TCMH568	Euphorbia hirta	Fei Yang Cao	飞杨草
TCMH845	Auricularia auricula-judae	Hei Mu Er	黑木耳
TCMH1796	Morus alba	Sang Shen Qing Gao	桑葚清膏
TCMH1139	Radix euphorbiae pekinensis	Jing Da Ji	京大戟
TCMH2072	Rhodomyrtus tomentosa	Tao Jin Niang Gen	桃金娘根
TCMH2710	Homo sapiens	Zi He Che	紫河车
TCMH517	Angelica pubescens	Du Huo	独活
TCMH526	Eucommia ulmoides	Du Zhong Ye	杜仲叶
TCMH423	Embelia parviflora	Dang Gui Teng	当归藤
TCMH422	Angelica sinensis	Dang Gui Gan Jin Gao	当归干浸膏
TCMH1245	Stellera chamaejasme	Lang Du	狼毒
TCMH1197	Selaginella tamariscina	Juan Bai	卷柏
TCMH1798	Morus alba	Sang Zhi	桑枝
TCMH1486	Ephedra sinica	Mi Ma Huang	蜜麻黄
TCMH2562	Ruta graveolens	Yun Xiang Jin Gao	芸香浸膏
TCMH1359	Pyrola calliantha	Lu Xian Cao	鹿衔草
TCMH2748	Datura stramonium	Zui Xian Tao	醉仙桃
TCMH1000	Foeniculum vulgare	Hui Xiang	茴香
TCMH202	Bombyx mori	Can Yong	蚕蛹
TCMH2449	Atropa belladonna	Ye Dian Qie	野颠茄
TCMH1658	Euphorbia lathyris	Qian Jin Zi	千金子
TCMH1179	Citri exocarpium rubrum	Ju Hong	橘红
TCMH148	Glehnia littoralis	Bei Sha Shen Liu Jin Gao	北沙参流浸膏
TCMH2282	Citrus medica	Xiang Yuan Pi	香橼皮
TCMH1437	Rhododendron dauricum	Man Shan Hong	满山红
TCMH13	Artemisia argyi	Ai Ye You	艾叶油
TCMH2211	Artemisia princeps	Wu Yue Ai	五月艾
TCMH1846	Artemisia capillaris	Shan Yin Chen	山茵陈
TCMH2154	Artemisia capillaris	Tu Yin Chen Hao	土茵陈蒿
TCMH2494	Artemisia capillaris	Yin Chen Hao	茵陈蒿
TCMH668	Rhodomyrtus tomentosa	Gang Ren Zi	岗稔子
TCMH421	Angelica sinensis	Dang Gui	当归
TCMH2281	Citrus medica	Xiang Yuan	香橼
TCMH524	Eucommia ulmoides	Du Zhong	杜仲
TCMH525	Eucommia ulmoides	Du Zhong Tan	杜仲炭
TCMH1734	Homo sapiens	Ren Zhong Bai	人中白
TCMH1398	Ephedra sinica	Ma Huang	麻黄
TCMH1399	Ephedra sinica	Ma Huang Gao	麻黄膏
TCMH1400	Ephedra sinica	Ma Huang Gen	麻黄根
TCMH1401	Ephedra sinica	Ma Huang Jin Gao	麻黄浸膏
TCMH371	Radix euphorbiae pekinensis	Da Ji	大戟
TCMH1215	Sophora flavescens	Ku Shen	苦参
TCMH2080	Sophora flavescens	Teng Ku Shen	藤苦参
TCMH279	Angelica pubescens	Chuan Du Huo	川独活
TCMH75	Bombyx mori	Bai Jiang Can	白僵蚕
TCMH197	Bombyx mori	Can E	蚕蛾
TCMH200	Bombyx mori	Can Jian	蚕茧
TCMH201	Bombyx mori	Can Sha	蚕砂
TCMH471	Atropa belladonna	Dian Qie Jin Gao	颠茄浸膏
TCMH472	Atropa belladonna	Dian Qie Liu Jin Gao	颠茄流浸膏
TCMH1792	Morus alba	Sang Pi	桑皮
TCMH1797	Morus alba	Sang Ye	桑叶
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH1782	Ruta graveolens	San Ya Ku	三桠苦
TCMH454	Euphorbia humifusa	Di Jin Cao	地锦草
TCMH584	Datura stramonium	Feng Qie Hua	枫茄花
TCMH1442	Datura stramonium	Man Tuo Luo	曼陀罗
TCMH1443	Datura stramonium	Man Tuo Luo Jin Gao	曼陀罗浸膏
TCMH1794	Morus alba	Sang Shen	桑葚
TCMH1795	Morus alba	Sang Shen Jin Gao	桑葚浸膏
TCMH253	Citrus aurantium	Cheng Pi	橙皮
TCMH2613	Citrus aurantium	Zhi Geng	枳梗
TCMH2618	Citrus aurantium	Zhi Ke	枳壳
TCMH2619	Citrus aurantium	Zhi Ke Gan Jin Gao	枳壳干浸膏
TCMH147	Glehnia littoralis	Bei Sha Shen	北沙参

Ingredient ID: TCMC2031
Formula: C27H30O16

Common Name	Rutin
IUPAC Name	2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one
Canonical SMILES	Oc1cc(O)c2c(c1)oc(c(c2=O)O[C@@H]1O[C@H](CO[C@@H]2O[C@@H](C)[C@@H]([C@H]([C@H]2O)O)O)[C@H]([C@@H]([C@H]1O)O)O)c1ccc(c(c1)O)O
Standard InCHI	InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1
Standard InCHIKey	IKGXIBQEEMLURG-NVPNHPEKSA-N
External Identifiers	ChEMBL [CHEMBL226335]; PubChem [5280805];
Reference of Component-Ingredient Pair	26408079

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1578	Eleusine indica	Niu Jin Cao	牛筋草
TCMH1860	Helicteres angustifolia	Shan Zhi Ma Gan Jin Gao	山芝麻干浸膏
TCMH945	Sophora japonica	Huai Zhi	槐枝
TCMH457	Euphorbia humifusa	Di Mian Cao	地绵草
TCMH2407	Bupleurum chinense	Yan Tai Chai Hu	烟台柴胡
TCMH1214	Picrasma quassioides	Ku Mu	苦木
TCMH924	Zanthoxylum bungeanum	Hua Jiao	花椒
TCMH2630	Citrus aurantium	Zhi Shi	枳实
TCMH888	Pithecellobium clypearia	Hou Er Huan Jin Gao	猴耳环浸膏
TCMH695	Uncaria rhynchophylla	Gou Teng	钩藤
TCMH101	Chelidonium majus	Bai Qu Cai	白屈菜
TCMH1264	Litchi chinensis	Li Zhi He	荔枝核
TCMH2506	Ginkgo biloba	Yin Xing Ye	银杏叶
TCMH2372	Bergenia purpurascens	Yan Bai Cai	岩白菜
TCMH2495	Artemisia capillaris	Yin Chen Hao Gan Jin Gao	茵陈蒿干浸膏
TCMH2012	Lycopus lucidus	Shui Ze Lan	水泽兰
TCMH63	Lilium brownii	Bai He Liu Jin Gao	百合流浸膏
TCMH2352	Saussurea involucrata	Xue Lian Hua	雪莲花
TCMH266	Clerodendrum bungei	Chu Mu Dan	臭牡丹
TCMH953	Aconitum vilmorinianum	Huang Cao Wu	黄草乌
TCMH1165	Murraya paniculata	Jiu Li Xiang	九里香
TCMH123	Pteris semipinnata	Ban Bian Qi	半边旗
TCMH2143	Sophora flavescens	Tu Ku Shen	土苦参
TCMH2134	Smilax glabra	Tu Fu Ling	土茯苓
TCMH1633	Taraxacum mongolicum	Pu Gong Ying Jin Gao	蒲公英浸膏
TCMH865	Carthamus tinctorius	Hong Hua	红花
TCMH1186	Lycium chinense	Gou Qi Zi	枸杞子
TCMH2150	Cuscuta australis	Tu Si Zi Teng	菟丝子藤
TCMH568	Euphorbia hirta	Fei Yang Cao	飞杨草
TCMH733	Desmodium styracifolium	Guang Jin Qian Cao	广金钱草
TCMH765	Entada phaseoloides	Guo Gang Long Jin Gao	过岗龙浸膏
TCMH921	Polygonum cuspidatum	Hu Zhang	虎杖
TCMH2244	Prunella vulgaris	Xia Ku Cao	夏枯草
TCMH316	Ailanthi cortex	Chun Pi	椿皮
TCMH2642	Gardenia jasminoides	Zhi Zi Jin Gao	栀子浸膏
TCMH2715	Ardisia japonica	Zi Jin Niu	紫金牛
TCMH1343	Aloe vera	Lu Hui	芦荟
TCMH985	Astragalus membranaceus	Huang Qi Ti Qu Ye	黄芪提取液
TCMH2456	Eupatorium lindleyanum	Ye Ma Zhui	野马追
TCMH2218	Rubia cordifolia	Qian Cao Teng	茜草藤
TCMH1162	Sarcandra glabra	Jiu Jie Cha	九节茶
TCMH1212	Melia azedarach	Ku Lian Zi	苦楝子
TCMH1649	Toxicodendron succedaneum	Qi Shu Gen	漆树根
TCMH1105	Trollius chinensis	Jin Lian Hua	金莲花
TCMH748	Euonymus alatus	Gui Jian Yu	鬼箭羽
TCMH2050	Punica granatum	Suan Shi Liu	酸石榴
TCMH2087	Grangea maderaspatana	Tian Ji Huang	田基黄
TCMH1096	Inula japonica	Jin Fei Cao	金沸草
TCMH215	Alpinia katsumadai	Cao Dou Kou Ren	草豆蔻仁
TCMH2462	Crataegus pinnatifida	Ye Shan Zha	野山楂
TCMH526	Eucommia ulmoides	Du Zhong Ye	杜仲叶
TCMH1299	Ganoderma lucidum	Ling Zhi(1)	灵芝
TCMH423	Embelia parviflora	Dang Gui Teng	当归藤
TCMH1322	Solanum nigrum	Long Kui	龙葵
TCMH905	Picrorhiza kurrooa	Hu Huang Lian	胡黄连
TCMH2322	Prunus armeniaca	Xing Ren	杏仁
TCMH388	Ziziphus jujuba	Da Zao	大枣
TCMH1930	Umbilicaria esculenta	Shi Er	石耳
TCMH1265	Chenopodium album	Li	藜
TCMH1953	Pyrrosia lingua	Shi Wei	石韦
TCMH2200	Firmiana simplex	Wu Tong Ye Jin Gao	梧桐叶浸膏
TCMH366	Rheum officinale	Da Huang Liu Jin Gao	大黄流浸膏
TCMH1601	Nelumbo nucifera	Ou Pian	藕片
TCMH255	Vigna angularis	Chi Dou	赤豆
TCMH1615	Eriobotrya japonica	Pi Ba Ren	枇杷仁
TCMH37	Smilax china	Ba Qia	菝葜
TCMH1518	Chaenomeles sinensis	Mu Gua	木瓜
TCMH2192	Prunus mume	Wu Mei Rou	乌梅肉
TCMH1493	Euphorbia pekinensis	Mian Da Ji	绵大戟
TCMH1798	Morus alba	Sang Zhi	桑枝
TCMH1033	Centella asiatica	Ji Xue Cao	积雪草
TCMH1486	Ephedra sinica	Mi Ma Huang	蜜麻黄
TCMH1854	Crataegi folium	Shan Zha Ye	山楂叶
TCMH2206	Schisandra chinensis	Wu Wei Zi Liu Jin Gao	五味子流浸膏
TCMH2285	Asparagus officinalis	Xiao Bai Bu	小百部
TCMH2545	Houttuynia cordata	Yu Xing Cao	鱼腥草
TCMH2113	Herba acalyphae	Tie Xian Cai	铁苋菜
TCMH1117	Rhizoma fagopyri cymosi	Jin Qiao Mai	金荞麦
TCMH2086	Trichosanthes kirilowii	Tian Hua Fen	天花粉
TCMH1396	Portulaca oleracea	Ma Chi Xian	马齿苋
TCMH1828	Ixeris chinensis	Shan Ku Mai	山苦荬
TCMH2297	Cirsium setosum	Xiao Ji	小蓟
TCMH1539	Cucurbita moschata	Nan Gua	南瓜
TCMH1766	Sparganium stoloniferum	San Ling	三棱
TCMH223	Platycladus orientalis	Ce Bai Tan	侧柏炭
TCMH1032	Impatiens balsamina	Ji Xing Zi	急性子
TCMH173	Lablab niger	Bian Dou	扁豆
TCMH1000	Foeniculum vulgare	Hui Xiang	茴香
TCMH500	Benincasa hispida	Dong Gua Zi	冬瓜子
TCMH1903	Zingiber officinale	Sheng Jiang	生姜
TCMH1100	Gymnema sylvestre	Jin Gang Tou	金刚头
TCMH1525	Crassostrea gigas	Mu Li	牡蛎
TCMH1448	Mangifera indica	Mang Guo Ye	芒果叶
TCMH2289	Urena lobata	Xiao Fan Tian Hua	肖梵天花
TCMH1483	Tussilago farfara	Mi Kuan Dong Hua	蜜款冬花
TCMH57	Wolfiporia cocos	Bai Fu Ling	白茯苓
TCMH1367	Apocynum venetum	Luo Bu Ma	罗布麻
TCMH76	Thlaspi arvense	Bai Jiang Cao	败酱草
TCMH1383	Onobrychis viciifolia	Lv Dou	绿豆
TCMH148	Glehnia littoralis	Bei Sha Shen Liu Jin Gao	北沙参流浸膏
TCMH1466	Rosa rugosa	Mei Gui Hua	玫瑰花
TCMH1247	Geranium wilfordii	Lao Guan Cao	老鹳草
TCMH936	Platycarya strobilacea	Hua Xiang Shu Guo Xu	化香树果序
TCMH71	Oldenlandia diffusa	Bai Hua She She Cao	白花蛇舌草
TCMH1272	Forsythia suspensa	Lian Qiao	连翘
TCMH1760	Saururus chinensis	San Bai Cao	三白草
TCMH2267	Periploca sepium	Xiang Jia Pi	香加皮
TCMH1804	Amomum villosum	Sha Ren Ye	砂仁叶
TCMH1184	Citrus reticulata	Ju Pi	橘皮
TCMH2135	Glycyrrhiza uralensis	Tu Gan Cao	土甘草
TCMH2282	Citrus medica	Xiang Yuan Pi	香橼皮
TCMH1437	Rhododendron dauricum	Man Shan Hong	满山红
TCMH1714	Lonicera japonica	Ren Dong Teng	忍冬藤
TCMH214	Alpinia katsumadai	Cao Dou Kou	草豆蔻
TCMH1846	Artemisia capillaris	Shan Yin Chen	山茵陈
TCMH2154	Artemisia capillaris	Tu Yin Chen Hao	土茵陈蒿
TCMH2494	Artemisia capillaris	Yin Chen Hao	茵陈蒿
TCMH590	Impatiens balsamina	Feng Xian Hua	凤仙花
TCMH591	Impatiens balsamina	Feng Xian Tou Gu Cao	凤仙透骨草
TCMH1803	Amomum villosum	Sha Ren	砂仁
TCMH737	Crataegus pinnatifida	Guang Shan Zha	广山楂
TCMH1848	Crataegus pinnatifida	Shan Zha	山楂
TCMH1849	Crataegus pinnatifida	Shan Zha Chou Gao	山楂稠膏
TCMH1852	Crataegus pinnatifida	Shan Zha Qing Gao	山楂清膏
TCMH1853	Crataegus pinnatifida	Shan Zha Tan	山楂炭
TCMH62	Lilium brownii	Bai He	百合
TCMH1127	Lonicera japonica	Jin Yin Hua	金银花
TCMH1128	Lonicera japonica	Jin Yin Hua Ti Qu Ye	金银花提取液
TCMH2281	Citrus medica	Xiang Yuan	香橼
TCMH524	Eucommia ulmoides	Du Zhong	杜仲
TCMH525	Eucommia ulmoides	Du Zhong Tan	杜仲炭
TCMH764	Entada phaseoloides	Guo Gang Long	过岗龙
TCMH498	Benincasa hispida	Dong Gua Pi	冬瓜皮
TCMH1185	Lycium chinense	Gou Qi	枸杞
TCMH1398	Ephedra sinica	Ma Huang	麻黄
TCMH1399	Ephedra sinica	Ma Huang Gao	麻黄膏
TCMH1400	Ephedra sinica	Ma Huang Gen	麻黄根
TCMH1401	Ephedra sinica	Ma Huang Jin Gao	麻黄浸膏
TCMH2098	Saussurea involucrata	Tian Shan Xue Lian Hua	天山雪莲花
TCMH2351	Saussurea involucrata	Xue Lian	雪莲
TCMH310	Melia azedarach	Chuan Lian	川楝
TCMH1211	Melia azedarach	Ku Lian Pi	苦楝皮
TCMH1215	Sophora flavescens	Ku Shen	苦参
TCMH2080	Sophora flavescens	Teng Ku Shen	藤苦参
TCMH938	Sophora japonica	Huai Hua	槐花
TCMH940	Sophora japonica	Huai Jiao	槐角
TCMH941	Sophora japonica	Huai Mi	槐米
TCMH363	Rheum officinale	Da Huang	大黄
TCMH365	Rheum officinale	Da Huang Jin Gao	大黄浸膏
TCMH1943	Punica granatum	Shi Liu	石榴
TCMH1944	Punica granatum	Shi Liu Pi	石榴皮
TCMH1945	Punica granatum	Shi Liu Zi	石榴子
TCMH705	Trichosanthes kirilowii	Gua Lou	瓜蒌
TCMH706	Trichosanthes kirilowii	Gua Lou Pi	瓜蒌皮
TCMH707	Trichosanthes kirilowii	Gua Lou Ren	瓜蒌仁
TCMH708	Trichosanthes kirilowii	Gua Lou Ren Shuang	瓜蒌仁霜
TCMH709	Trichosanthes kirilowii	Gua Lou Shi	栝蒌实
TCMH711	Trichosanthes kirilowii	Gua Lou Gen	栝楼根
TCMH712	Trichosanthes kirilowii	Gua Lou Ren(1)	栝楼仁
TCMH981	Astragalus membranaceus	Huang Qi	黄芪
TCMH983	Astragalus membranaceus	Huang Qi Gan Jin Gao	黄芪干浸膏
TCMH984	Astragalus membranaceus	Huang Qi Jin Gao	黄芪浸膏
TCMH1296	Ganoderma lucidum	Ling Zhi Jin Gao	灵芝浸膏
TCMH1178	Citrus reticulata	Ju He	橘核
TCMH978	Taraxacum mongolicum	Huang Miao	黄苗
TCMH1632	Taraxacum mongolicum	Pu Gong Ying	蒲公英
TCMH935	Platycarya strobilacea	Hua Xiang Shu Guo	化香树果
TCMH1792	Morus alba	Sang Pi	桑皮
TCMH1797	Morus alba	Sang Ye	桑叶
TCMH2148	Cuscuta australis	Tu Si Rou	菟丝肉
TCMH2149	Cuscuta australis	Tu Si Zi	菟丝子
TCMH93	Prunus mume	Bai Mei Hua	白梅花
TCMH2191	Prunus mume	Wu Mei	乌梅
TCMH1099	Gymnema sylvestre	Jin Gang Teng	金刚藤
TCMH221	Sarcandra glabra	Cao Shan Hu Jin Gao	草珊瑚浸膏
TCMH228	Bupleurum chinense	Chai Hu	柴胡
TCMH229	Bupleurum chinense	Chai Hu Jin Gao	柴胡浸膏
TCMH230	Bupleurum chinense	Chai Hu Shao	柴胡梢
TCMH461	Urena lobata	Di Tao Hua	地桃花
TCMH60	Ginkgo biloba	Bai Guo	白果
TCMH61	Ginkgo biloba	Bai Guo Ren	白果仁
TCMH814	Nelumbo nucifera	He Geng	荷梗
TCMH825	Nelumbo nucifera	He Ye	荷叶
TCMH1275	Nelumbo nucifera	Lian Zi	莲子
TCMH1276	Nelumbo nucifera	Lian Zi Xin	莲子心
TCMH1598	Nelumbo nucifera	Ou	藕
TCMH1599	Nelumbo nucifera	Ou Fen	藕粉
TCMH1223	Tussilago farfara	Kuan Dong Hua	款冬花
TCMH454	Euphorbia humifusa	Di Jin Cao	地锦草
TCMH628	Glycyrrhiza uralensis	Gan Cao	甘草
TCMH629	Glycyrrhiza uralensis	Gan Cao Fen	甘草粉
TCMH630	Glycyrrhiza uralensis	Gan Cao Gan Gao	甘草干膏
TCMH631	Glycyrrhiza uralensis	Gan Cao Gan Gao Fen	甘草干膏粉
TCMH632	Glycyrrhiza uralensis	Gan Cao Gan Jin Gao	甘草干浸膏
TCMH633	Glycyrrhiza uralensis	Gan Cao Gao	甘草膏
TCMH634	Glycyrrhiza uralensis	Gan Cao Jie	甘草节
TCMH635	Glycyrrhiza uralensis	Gan Cao Jin Gao	甘草浸膏
TCMH636	Glycyrrhiza uralensis	Gan Cao Liu Jin Gao	甘草流浸膏
TCMH1475	Glycyrrhiza uralensis	Mi Gan Cao	蜜甘草
TCMH1899	Glycyrrhiza uralensis	Sheng Gan Cao	生甘草
TCMH1859	Helicteres angustifolia	Shan Zhi Ma	山芝麻
TCMH253	Citrus aurantium	Cheng Pi	橙皮
TCMH2613	Citrus aurantium	Zhi Geng	枳梗
TCMH2618	Citrus aurantium	Zhi Ke	枳壳
TCMH2619	Citrus aurantium	Zhi Ke Gan Jin Gao	枳壳干浸膏
TCMH1928	Asparagus officinalis	Shi Diao Bai	石刁柏
TCMH2202	Schisandra chinensis	Wu Wei Zi	五味子
TCMH2203	Schisandra chinensis	Wu Wei Zi Chun Jin Gao	五味子醇浸膏
TCMH2204	Schisandra chinensis	Wu Wei Zi Jin Chu Wu	五味子浸出物
TCMH2205	Schisandra chinensis	Wu Wei Zi Jin Gao	五味子浸膏
TCMH886	Pithecellobium clypearia	Hou Er Huan	猴耳环
TCMH887	Pithecellobium clypearia	Hou Er Huan Gan Jin Gao	猴耳环干浸膏
TCMH147	Glehnia littoralis	Bei Sha Shen	北沙参
TCMH1856	Gardenia jasminoides	Shan Zhi	山栀
TCMH2641	Gardenia jasminoides	Zhi Zi	栀子

Ingredient ID: TCMC1844
Formula: C17H14O6

Common Name	Pectolinarigenin
IUPAC Name	5,7-dihydroxy-6-methoxy-2-(4-methoxyphenyl)chromen-4-one
Canonical SMILES	COc1ccc(cc1)c1cc(=O)c2c(o1)cc(c(c2O)OC)O
Standard InCHI	InChI=1S/C17H14O6/c1-21-10-5-3-9(4-6-10)13-7-11(18)15-14(23-13)8-12(19)17(22-2)16(15)20/h3-8,19-20H,1-2H3
Standard InCHIKey	GPQLHGCIAUEJQK-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL78010]; PubChem [5320438];
Reference of Component-Ingredient Pair	22978219

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木
TCMH888	Pithecellobium clypearia	Hou Er Huan Jin Gao	猴耳环浸膏
TCMH2372	Bergenia purpurascens	Yan Bai Cai	岩白菜
TCMH2495	Artemisia capillaris	Yin Chen Hao Gan Jin Gao	茵陈蒿干浸膏
TCMH370	Herba cirsii japonici	Da Ji(1)	大蓟
TCMH2642	Gardenia jasminoides	Zhi Zi Jin Gao	栀子浸膏
TCMH1141	Schizonepeta tenuifolia	Jing Jie	荆芥
TCMH1105	Trollius chinensis	Jin Lian Hua	金莲花
TCMH874	Herba lagotidis	Hong Lian	洪连
TCMH1142	Schizonepetae spica	Jing Jie Sui	荆芥穗
TCMH1846	Artemisia capillaris	Shan Yin Chen	山茵陈
TCMH2154	Artemisia capillaris	Tu Yin Chen Hao	土茵陈蒿
TCMH2494	Artemisia capillaris	Yin Chen Hao	茵陈蒿
TCMH368	Herba cirsii japonici	Da Ji Gen	大蓟根
TCMH369	Herba cirsii japonici	Da Ji Gen Jin Gao	大蓟根浸膏
TCMH886	Pithecellobium clypearia	Hou Er Huan	猴耳环
TCMH887	Pithecellobium clypearia	Hou Er Huan Gan Jin Gao	猴耳环干浸膏
TCMH1856	Gardenia jasminoides	Shan Zhi	山栀
TCMH2641	Gardenia jasminoides	Zhi Zi	栀子

Ingredient ID: TCMC1759
Formula: C11H8N2

Common Name	Norharmane
IUPAC Name	9H-pyrido[3,4-b]indole
Canonical SMILES	c1ccc2c(c1)[nH]c1c2ccnc1
Standard InCHI	InChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-7,13H
Standard InCHIKey	AIFRHYZBTHREPW-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL275224]; PubChem [64961];
Reference of Component-Ingredient Pair	28336214

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木
TCMH2556	Polygala tenuifolia	Yuan Zhi Liu Jin Gao	远志流浸膏
TCMH2710	Homo sapiens	Zi He Che	紫河车
TCMH1734	Homo sapiens	Ren Zhong Bai	人中白
TCMH2554	Polygala tenuifolia	Yuan Zhi	远志
TCMH2555	Polygala tenuifolia	Yuan Zhi Jin Gao	远志浸膏

Ingredient ID: TCMC1640
Formula: C15H10N2O3

Common Name	n.a.
IUPAC Name	n.a.
Canonical SMILES	COc1c(O)c(=O)n2c3c1nccc3c1c2cccc1
Standard InCHI	InChI=1S/C15H10N2O3/c1-20-14-11-12-9(6-7-16-11)8-4-2-3-5-10(8)17(12)15(19)13(14)18/h2-7,18H,1H3
Standard InCHIKey	PGFKZUOYIFDMQJ-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL1594741]; PubChem [N/A];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木

Ingredient ID: TCMC1629
Formula: C16H12O5

Common Name	n.a.
IUPAC Name	n.a.
Canonical SMILES	Oc1ccc2c(c1)OCC1C2Oc2c1cc1c(c2)OCO1
Standard InCHI	InChI=1S/C16H12O5/c17-8-1-2-9-12(3-8)18-6-11-10-4-14-15(20-7-19-14)5-13(10)21-16(9)11/h1-5,11,16-17H,6-7H2
Standard InCHIKey	HUKSJTUUSUGIDC-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL239047]; PubChem [363863];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH945	Sophora japonica	Huai Zhi	槐枝
TCMH1214	Picrasma quassioides	Ku Mu	苦木
TCMH2143	Sophora flavescens	Tu Ku Shen	土苦参
TCMH1814	Sophora subprostrata	Shan Dou Gen	山豆根
TCMH1215	Sophora flavescens	Ku Shen	苦参
TCMH2080	Sophora flavescens	Teng Ku Shen	藤苦参
TCMH938	Sophora japonica	Huai Hua	槐花
TCMH940	Sophora japonica	Huai Jiao	槐角
TCMH941	Sophora japonica	Huai Mi	槐米

Ingredient ID: TCMC1519
Formula: C16H12O5

Common Name	Maackiain
IUPAC Name	n.a.
Canonical SMILES	Oc1ccc2c(c1)OC[C@@H]1[C@H]2Oc2c1cc1c(c2)OCO1
Standard InCHI	InChI=1S/C16H12O5/c17-8-1-2-9-12(3-8)18-6-11-10-4-14-15(20-7-19-14)5-13(10)21-16(9)11/h1-5,11,16-17H,6-7H2/t11-,16-/m0/s1
Standard InCHIKey	HUKSJTUUSUGIDC-ZBEGNZNMSA-N
External Identifiers	ChEMBL [CHEMBL334918]; PubChem [91510];
Reference of Component-Ingredient Pair	11413204

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1214	Picrasma quassioides	Ku Mu	苦木
TCMH266	Clerodendrum bungei	Chu Mu Dan	臭牡丹
TCMH2143	Sophora flavescens	Tu Ku Shen	土苦参
TCMH1139	Radix euphorbiae pekinensis	Jing Da Ji	京大戟
TCMH423	Embelia parviflora	Dang Gui Teng	当归藤
TCMH1486	Ephedra sinica	Mi Ma Huang	蜜麻黄
TCMH538	Oxytropis falcata	E Da Xia	莪大夏
TCMH79	Sinapis alba	Bai Jie Zi	白芥子
TCMH1398	Ephedra sinica	Ma Huang	麻黄
TCMH1399	Ephedra sinica	Ma Huang Gao	麻黄膏
TCMH1400	Ephedra sinica	Ma Huang Gen	麻黄根
TCMH1401	Ephedra sinica	Ma Huang Jin Gao	麻黄浸膏
TCMH371	Radix euphorbiae pekinensis	Da Ji	大戟
TCMH1215	Sophora flavescens	Ku Shen	苦参
TCMH2080	Sophora flavescens	Teng Ku Shen	藤苦参

Ingredient ID: TCMC1105
Formula: C15H10O5

Common Name	Emodin
IUPAC Name	1,3,8-trihydroxy-6-methylanthracene-9,10-dione
Canonical SMILES	Cc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1)O
Standard InCHI	InChI=1S/C15H10O5/c1-6-2-8-12(10(17)3-6)15(20)13-9(14(8)19)4-7(16)5-11(13)18/h2-5,16-18H,1H3
Standard InCHIKey	RHMXXJGYXNZAPX-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL289277]; PubChem [3220];
Reference of Component-Ingredient Pair	29045746

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH86	Ampelopsis japonica	Bai Lian	白蔹
TCMH1214	Picrasma quassioides	Ku Mu	苦木
TCMH1199	Cassia tora	Jue Ming Zi	决明子
TCMH2347	Ventilago leiocarpa	Xue Feng Teng	血风藤
TCMH921	Polygonum cuspidatum	Hu Zhang	虎杖
TCMH1589	Rumex patientia	Niu Xi Xi	牛西西
TCMH1923	Acorus tatarinowii	Shi Chang Pu Qing Gao	石菖蒲清膏
TCMH699	Eriocaulon buergerianum	Gu Jing Cao	谷精草
TCMH2087	Grangea maderaspatana	Tian Ji Huang	田基黄
TCMH2728	Aster tataricus	Zi Wan	紫菀
TCMH829	Semen pharbitidis	Hei Chou	黑丑
TCMH366	Rheum officinale	Da Huang Liu Jin Gao	大黄流浸膏
TCMH819	Polygonum multiflorum	He Shou Wu	何首乌
TCMH1117	Rhizoma fagopyri cymosi	Jin Qiao Mai	金荞麦
TCMH500	Benincasa hispida	Dong Gua Zi	冬瓜子
TCMH2624	Anemarrhena asphodeloides	Zhi Mu	知母
TCMH961	Artemisia scoparia	Huang Hao	黄蒿
TCMH2135	Glycyrrhiza uralensis	Tu Gan Cao	土甘草
TCMH1965	Rheum palmatum	Shu Da Huang	熟大黄
TCMH498	Benincasa hispida	Dong Gua Pi	冬瓜皮
TCMH52	Semen pharbitidis	Bai Chou	白丑
TCMH363	Rheum officinale	Da Huang	大黄
TCMH365	Rheum officinale	Da Huang Jin Gao	大黄浸膏
TCMH557	Aster tataricus	Fan Hun Cao	返魂草
TCMH939	Aster tataricus	Huai Hun Cao	还魂草
TCMH1490	Aster tataricus	Mi Zi Wan	蜜紫菀
TCMH628	Glycyrrhiza uralensis	Gan Cao	甘草
TCMH629	Glycyrrhiza uralensis	Gan Cao Fen	甘草粉
TCMH630	Glycyrrhiza uralensis	Gan Cao Gan Gao	甘草干膏
TCMH631	Glycyrrhiza uralensis	Gan Cao Gan Gao Fen	甘草干膏粉
TCMH632	Glycyrrhiza uralensis	Gan Cao Gan Jin Gao	甘草干浸膏
TCMH633	Glycyrrhiza uralensis	Gan Cao Gao	甘草膏
TCMH634	Glycyrrhiza uralensis	Gan Cao Jie	甘草节
TCMH635	Glycyrrhiza uralensis	Gan Cao Jin Gao	甘草浸膏
TCMH636	Glycyrrhiza uralensis	Gan Cao Liu Jin Gao	甘草流浸膏
TCMH1475	Glycyrrhiza uralensis	Mi Gan Cao	蜜甘草
TCMH1899	Glycyrrhiza uralensis	Sheng Gan Cao	生甘草
TCMH1920	Acorus tatarinowii	Shi Chang Pu	石菖蒲
TCMH1922	Acorus tatarinowii	Shi Chang Pu Jin Gao	石菖蒲浸膏

Properties

Ingredient ID	Formulae	Name	MW	AlogP	MlogP	XlogP	# HBA	# HBD	PSA	# Rotatable Bond	# Ring	# Heacy Atom	Lipinski RO5 Violation
TCMC272	C13H10N2O	1-Acetyl-Beta-Carboline	210.08	-0.6743	2.56	2.79	3	1	45.75	2	3	16	0
TCMC281	C13H10N2O2	1-Methoxycarbonyl-Beta-Carboline	226.07	-0.4092	2.45	2.846	4	1	54.98	3	3	17	0
TCMC470	C16H12N2O3	4,5-Dimethoxycanthin-6-One	280.08	-1.1642	2.67	2.956	5	0	53.35	4	4	21	0
TCMC559	C15H10N2O2	5-Methoxycanthinone	250.07	-0.6656	2.67	3.049	4	0	44.12	2	4	19	0
TCMC579	C7H14O6	6-Methoxycyclohexane-1,2,3,4,5-Pentol	194.08	-2.6557	1.57	-1.797	6	5	110.38	7	1	13	0
TCMC865	C14H8N2O	Canthin-6-One	220.06	-0.2737	2.67	2.809	3	0	34.89	0	4	17	0
TCMC1105	C15H10O5	Emodin	270.05	-1.2665	2.56	0.664	2	3	94.83	4	3	20	0
TCMC1519	C16H12O5	Maackiain	284.07	-1.4161	2.67	1.797	0	1	57.15	1	5	21	0
TCMC1629	C16H12O5		284.07	-1.4161	2.67	1.797	0	1	57.15	1	5	21	0
TCMC1640	C15H10N2O3		266.07	-1.2287	2.56	3.064	5	1	64.35	3	4	20	0
TCMC1759	C11H8N2	Norharmane	168.07	-0.4204	2.45	2.471	2	1	28.68	0	3	13	0
TCMC1844	C17H14O6	Pectolinarigenin	314.08	-1.5278	2.67	1.642	1	2	85.22	7	3	23	0
TCMC2031	C27H30O16	Rutin	610.15	-6.139	2.67	-1.188	11	10	265.52	17	5	43	2
TCMC2204	C9H6O3	Umbelliferone	162.03	-0.1903	2.12	1.532	1	1	46.53	1	2	12	0
TCMC2375	C22H28O6	Quassin	388.19	0.374	3.22	1.605	6	0	78.9	8	4	28	0
TCMC2536	C15H10N2O3	Picrasidine Q	266.07	-1.2287	2.56	2.635	5	1	64.35	3	4	20	0
TCMC2603	C7H8O2	Methylhydroquinone	124.05	-0.2786	2.01	0.982	0	2	40.46	3	1	9	0
TCMC3681	C23H34O7	Nigakilactone J	422.2304534	-0.0988	3.22	2.114	7	1	99.13	3	4	30	0
TCMC3690	C24H34O7	Nigakilactone C	434.2304534	0.2322	3.33	2.571	7	0	88.13	4	4	31	0
TCMC3691	C26H34O8	Nigakilactone G	474.225368	-0.3933	3.44	0.914	8	1	116.2	3	5	34	0
TCMC4562	C13H10N2O2	1-Formyl-4-Methoxy-Β-Carboline	226.0742276	-0.6646	2.45	2.495	3	1	54.98	2	3	17	0
TCMC4684	C15H14N2O2	Kumujian G	254.1055277	0.1835	2.67	2.23	2	1	47.14	3	3	19	0
TCMC4807	C22H30O6	Neoquassin	390.2042387	-0.3399	3.22	1.377	6	1	82.06	2	4	28	0
TCMC5417	C21H30O6	Nigakilactone A	378.2042387	-0.5554	3.11	1.741	6	2	93.06	1	4	27	0
TCMC5933	C21H28O6	Nigakilactone I	376.1885886	0.043	3.11	1.148	6	1	89.9	1	4	27	0
TCMC6590	C22H28O6	Picrasmin	388.1885886	0.374	3.22	1.605	6	0	78.9	2	4	28	0

Download Data

All data can be downloaded by:

→ Selecting data type in the below download table
→ Then click the download button.

Data Section	Select to Download
1. General Information of the Component
2. TCM Prescriptions with the Component
3. Putative Targets
4. Activity & References for Filtering Putative Targets
5. Ingredient Data & Chemical Structure Information (Properties, InChI, InChIkey, SMILES, etc.)

Component: Picrasma quassioides 苦木

Description of the Component

Component ID

Latin Name

English Name

Chinese Pinyin Name

中文名

TCM Properties

TCM Meridians

Therapeutic Class English

Therapeutic Class Chinese

Functions

Toxicity

Geo-authentic habitats (道地产区)

Reference

Barcode ID

Barcode Source

TCM Prescriptions with the Component

Targeted Human Proteins by the Ingredient of Component

Targeted Pathogenic Microbes by the Ingredient of Component

Ingredient Structrues

Ingredient ID: TCMC865

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6590

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5933

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC579

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC559

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5417

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC4807

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC470

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC4684

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC4562

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3691

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3690

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3681

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC281

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC272

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2603

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2536

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2375

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2204

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2031

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC1844

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC1759

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC1640

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC1629

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC1519

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC1105

Occurrence of the ingredient across TCM components

Properties

Download Data