TCM-ID Component

Description of the Component

Component ID	TCMH238
Latin Name	Dichroa febrifuga
English Name	Antifebrile dichroa
Chinese Pinyin Name	Chang Shan
中文名	å¸¸å±±
TCM Properties	Cold,Pungent,Bitter
TCM Meridians	Lung,Liver,Heart
Therapeutic Class English	Vomiting promotion
Therapeutic Class Chinese	æ¶Œå
Functions	expel phlegm and relieve malaria
Toxicity	Extremely Toxic
Geo-authentic habitats (道地产区)	Sichuan Province,Chongqing
Reference	Chinese Pharmacopoeia (2015)
Barcode ID	ITSAJ4406-14
Barcode Source	BOLDSYSTEMS

TCM Prescriptions with the Component

Prescription ID	Prescription English Name	Prescription Chinese Name
TCMF2040	Decoction of Seven Fine Drugs for Malaria	æˆªç–Ÿä¸ƒå®é¥®
TCMF4690	Jie Nue Qi Bao Pills	æˆªç–Ÿä¸ƒå®ä¸¸
TCMFx4520	Jiu Long Hua Feng Pills	ä¹é¾™åŒ–é£Žä¸¸
TCMFx1937	Powder of Concha Ostreae and Alismatis	ç‰¡è›Žæ³½æ³»æ•£
TCMF5839	Sheng Ji Bie Jia Pills	åœ£æµŽé³–ç”²ä¸¸
TCMF50	Xin Su Ning Capsule	å¿ƒé€Ÿå®èƒ¶å›Š

Targeted Human Proteins by the Ingredient of Component

Target ID	Gene Symbol	Target Name	Target Class	Uniprot ID
TCMT2	MAPT	Microtubule-associated protein tau	Unclassified	P10636
TCMT226	PDPK1	3-phosphoinositide dependent protein kinase-1	Kinase	O15530
TCMT3	ALOX15	Arachidonate 15-lipoxygenase	Oxidoreductase	P16050
TCMT31	CYP2C19	Cytochrome P450 2C19	Oxidoreductase	P33261
TCMT33	CYP3A4	Cytochrome P450 3A4	Oxidoreductase	P08684
TCMT739	GPR35	G-protein coupled receptor 35	GPCR	Q9HC97
TCMT827	NQO1	Quinone reductase 1)	Oxidoreductase	P15559
TCMT87	CYP2C9	Cytochrome P450 2C9	Oxidoreductase	P11712

Targeted Pathogenic Microbes by the Ingredient of Component

Target ID	Target Name
TCMT1382	Plasmodium falciparum (isolate K1 / Thailand)
TCMT1438	Plasmodium falciparum

Ingredient Structrues

Ingredient ID: TCMC5548
Formula: C16H19N3O3

Common Name	Î‘-Dichroine
IUPAC Name	3-[[(2R,3aS,7aS)-2-hydroxy-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridin-2-yl]methyl]quinazolin-4-one
Canonical SMILES	O=c1n(cnc2c1cccc2)C[C@]1(O)O[C@@H]2[C@H](C1)[NH2+]CCC2
Standard InCHI	InChI=1S/C16H19N3O3/c20-15-11-4-1-2-5-12(11)18-10-19(15)9-16(21)8-13-14(22-16)6-3-7-17-13/h1-2,4-5,10,13-14,17,21H,3,6-9H2/p+1/t13-,14-,16+/m0/s1
Standard InCHIKey	YLYLCQRQSRDSQR-OFQRWUPVSA-O
External Identifiers	ChEMBL [N/A]; PubChem [10968628];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH238	Dichroa febrifuga	Chang Shan	å¸¸å±±

Ingredient ID: TCMC4974
Formula: C20H20O4

Common Name	Dichrin B,Licarin B
IUPAC Name	5-[(3S)-7-methoxy-3-methyl-5-[(E)-prop-1-enyl]-2,3-dihydro-1-benzofuran-2-yl]-1,3-benzodioxole
Canonical SMILES	C/C=C/c1cc2c(c(c1)OC)OC([C@H]2C)c1ccc2c(c1)OCO2
Standard InCHI	InChI=1S/C20H20O4/c1-4-5-13-8-15-12(2)19(24-20(15)18(9-13)21-3)14-6-7-16-17(10-14)23-11-22-16/h4-10,12,19H,11H2,1-3H3/b5-4+/t12-,19?/m0/s1
Standard InCHIKey	DMMQXURQRMNSBM-SWDBHPRBSA-N
External Identifiers	ChEMBL [N/A]; PubChem [5384942];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH512	Fructus amomi rotundus	Dou Kou	è±†è”»
TCMH238	Dichroa febrifuga	Chang Shan	å¸¸å±±

Ingredient ID: TCMC4490
Formula: C10H8O4

Common Name	7-Hydroxy-8-Methoxycoumarin,Daphnetin-8-Methyl Ether
IUPAC Name	7-hydroxy-8-methoxychromen-2-one
Canonical SMILES	COc1c(O)ccc2c1oc(=O)cc2
Standard InCHI	InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3
Standard InCHIKey	HAQWEMHXSIRYBE-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL2331585]; PubChem [5316302];
Reference of Component-Ingredient Pair	21082271

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH238	Dichroa febrifuga	Chang Shan	å¸¸å±±
TCMH1681	Artemisia carvifolia	Qing Hao	é’è’¿

Ingredient ID: TCMC3421
Formula: C15H12O4

Common Name	Hydrangenol
IUPAC Name	8-hydroxy-3-(4-hydroxyphenyl)-3,4-dihydroisochromen-1-one
Canonical SMILES	Oc1ccc(cc1)C1OC(=O)c2c(C1)cccc2O
Standard InCHI	InChI=1S/C15H12O4/c16-11-6-4-9(5-7-11)13-8-10-2-1-3-12(17)14(10)15(18)19-13/h1-7,13,16-17H,8H2
Standard InCHIKey	DGKDFNDHPXVXHW-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL69299]; PubChem [119199];
Reference of Component-Ingredient Pair	21582163

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH238	Dichroa febrifuga	Chang Shan	å¸¸å±±

Ingredient ID: TCMC3170
Formula: C2CaO4

Common Name	Calcium Oxalate
IUPAC Name	calcium;oxalate
Canonical SMILES	[O-]C(=O)C(=O)[O-].[Ca+2]
Standard InCHI	InChI=1S/C2H2O4.Ca/c3-1(4)2(5)6;/h(H,3,4)(H,5,6);/q;+2/p-2
Standard InCHIKey	QXDMQSPYEZFLGF-UHFFFAOYSA-L
External Identifiers	ChEMBL [CHEMBL3184709]; PubChem [33005];
Reference of Component-Ingredient Pair	29413701

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH238	Dichroa febrifuga	Chang Shan	å¸¸å±±

Ingredient ID: TCMC2393
Formula: C16H19N3O3

Common Name	Febrifugine
IUPAC Name	3-[3-[(2S,3R)-3-hydroxypiperidin-2-yl]-2-oxopropyl]quinazolin-4-one
Canonical SMILES	O=C(Cn1cnc2c(c1=O)cccc2)C[C@@H]1NCCC[C@H]1O
Standard InCHI	InChI=1S/C16H19N3O3/c20-11(8-14-15(21)6-3-7-17-14)9-19-10-18-13-5-2-1-4-12(13)16(19)22/h1-2,4-5,10,14-15,17,21H,3,6-9H2/t14-,15+/m0/s1
Standard InCHIKey	FWVHWDSCPKXMDB-LSDHHAIUSA-N
External Identifiers	ChEMBL [CHEMBL479432]; PubChem [63224];
Reference of Component-Ingredient Pair	22593757

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH238	Dichroa febrifuga	Chang Shan	å¸¸å±±

Ingredient ID: TCMC2232
Formula: C29H50O2

Common Name	Vitamin E
IUPAC Name	(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-ol
Canonical SMILES	C[C@@H](CCC[C@]1(C)CCc2c(O1)c(C)c(c(c2C)O)C)CCC[C@@H](CCCC(C)C)C
Standard InCHI	InChI=1S/C29H50O2/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8)19-17-26-25(7)27(30)23(5)24(6)28(26)31-29/h20-22,30H,9-19H2,1-8H3/t21-,22-,29-/m1/s1
Standard InCHIKey	GVJHHUAWPYXKBD-IEOSBIPESA-N
External Identifiers	ChEMBL [CHEMBL47]; PubChem [14985];
Reference of Component-Ingredient Pair	23122131

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH914	Sesamum indicum	Hu Ma Ren	èƒ¡éº»ä»
TCMH1240	Raphanus sativus	Lai Fu Zi	èŽ±è”å
TCMH1633	Taraxacum mongolicum	Pu Gong Ying Jin Gao	è’²å…¬è‹±æµ¸è†
TCMH238	Dichroa febrifuga	Chang Shan	å¸¸å±±
TCMH1499	Changium smyrnioides	Ming Dang Shen	æ˜Žå…šå‚
TCMH409	Salvia miltiorrhiza	Dan Shen Jin Gao	ä¸¹å‚æµ¸è†
TCMH827	Terminalia chebula	He Zi Rou	è¯ƒåè‚‰
TCMH445	Hypericum japonicum	Di Er Cao	åœ°è€³è‰
TCMH108	Perilla frutescens	Bai Su Zi	ç™½è‹å
TCMH428	Codonopsis pilosula	Dang Shen Qing Gao	å…šå‚æ¸…è†
TCMH1708	Polygonum bistorta	Quan Shen	æ‹³å‚
TCMH859	Ormosia hosiei	Hong Dou	çº¢è±†
TCMH388	Ziziphus jujuba	Da Zao	å¤§æž£
TCMH49	Stemona tuberosa	Bai Bu Liu Jin Gao	ç™¾éƒ¨æµæµ¸è†
TCMH1798	Morus alba	Sang Zhi	æ¡‘æž
TCMH1090	Brassica juncea	Jie Zi	èŠ¥å
TCMH1903	Zingiber officinale	Sheng Jiang	ç”Ÿå§œ
TCMH430	Canavalia gladiata	Dao Dou	åˆ€è±†
TCMH1588	Achyranthes bidentata	Niu Xi	ç‰›è†
TCMH1667	Fagopyrum esculentum	Qiao Mai	èžéº¦
TCMH1643	Syzygium jambos	Pu Tao(1)	è’²æ¡ƒ
TCMH906	Viscum coloratum	Hu Ji Sheng	æ§²å¯„ç”Ÿ
TCMH79	Sinapis alba	Bai Jie Zi	ç™½èŠ¥å
TCMH1584	Achyranthes bidentata	Niu Teng	ç‰›è—¤
TCMH426	Codonopsis pilosula	Dang Shen	å…šå‚
TCMH1734	Homo sapiens	Ren Zhong Bai	äººä¸ç™½
TCMH46	Stemona tuberosa	Bai Bu	ç™¾éƒ¨
TCMH47	Stemona tuberosa	Bai Bu Gan Gao	ç™¾éƒ¨å¹²è†
TCMH48	Stemona tuberosa	Bai Bu Jin Gao	ç™¾éƒ¨æµ¸è†
TCMH1943	Punica granatum	Shi Liu	çŸ³æ¦´
TCMH1944	Punica granatum	Shi Liu Pi	çŸ³æ¦´çš®
TCMH1945	Punica granatum	Shi Liu Zi	çŸ³æ¦´å
TCMH848	Sesamum indicum	Hei Zhi Ma	é»‘èŠéº»
TCMH913	Sesamum indicum	Hu Ma	èƒ¡éº»
TCMH210	Terminalia chebula	Cang Qing Guo	è—é’æžœ
TCMH826	Terminalia chebula	He Zi	è¯ƒå
TCMH978	Taraxacum mongolicum	Huang Miao	é»„è‹—
TCMH1632	Taraxacum mongolicum	Pu Gong Ying	è’²å…¬è‹±
TCMH1792	Morus alba	Sang Pi	æ¡‘çš®
TCMH1797	Morus alba	Sang Ye	æ¡‘å¶
TCMH407	Salvia miltiorrhiza	Dan Shen	ä¸¹å‚
TCMH408	Salvia miltiorrhiza	Dan Shen Gan Jin Gao	ä¸¹å‚å¹²æµ¸è†
TCMH195	Raphanus sativus	Cai Fu Zi	èœè”å
TCMH1239	Raphanus sativus	Lai Fu	èŽ±è”
TCMH2710	Homo sapiens	Zi He Che	ç´«æ²³è½¦
TCMH2050	Punica granatum	Suan Shi Liu	é…¸çŸ³æ¦´
TCMH2322	Prunus armeniaca	Xing Ren	æä»

Ingredient ID: TCMC1991
Formula: C8H6N2O

Common Name	Quinazolinone
IUPAC Name	1H-quinazolin-4-one
Canonical SMILES	Oc1ncnc2c1cccc2
Standard InCHI	InChI=1S/C8H6N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-5H,(H,9,10,11)
Standard InCHIKey	QMNUDYFKZYBWQX-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL266540]; PubChem [63112];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH238	Dichroa febrifuga	Chang Shan	å¸¸å±±
TCMH1512	Isatis indigotica	Mu Da Qing Ye	æœ¨å¤§é’å¶
TCMH126	Isatis indigotica	Ban Lan	æ¿è“
TCMH127	Isatis indigotica	Ban Lan Gen	æ¿è“æ ¹
TCMH381	Isatis indigotica	Da Qing Ye	å¤§é’å¶
TCMH1510	Isatis indigotica	Mu Ban Lan Gen	æœ¨æ¿è“æ ¹

Ingredient ID: TCMC1034
Formula: C19H12O6

Common Name	Dicumarol
IUPAC Name	4-hydroxy-3-[(4-hydroxy-2-oxochromen-3-yl)methyl]chromen-2-one
Canonical SMILES	O=c1oc2ccccc2c(c1Cc1c(=O)oc2c(c1O)cccc2)O
Standard InCHI	InChI=1S/C19H12O6/c20-16-10-5-1-3-7-14(10)24-18(22)12(16)9-13-17(21)11-6-2-4-8-15(11)25-19(13)23/h1-8,20-21H,9H2
Standard InCHIKey	DOBMPNYZJYQDGZ-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL1466]; PubChem [54676038];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH238	Dichroa febrifuga	Chang Shan	å¸¸å±±

Properties

Ingredient ID	Formulae	Name	MW	AlogP	MlogP	XlogP	# HBA	# HBD	PSA	# Rotatable Bond	# Ring	# Heacy Atom	Lipinski RO5 Violation
TCMC1034	C19H12O6	Dicumarol	336.06	-0.3078	2.89	4.227	4	2	93.06	4	4	25	0
TCMC1991	C8H6N2O	Quinazolinone	146.05	-0.4603	2.01	1.634	2	1	46.01	1	2	11	0
TCMC2232	C29H50O2	Vitamin E	430.38	3.2935	4.43	10.938	0	1	29.46	21	2	31	2
TCMC2393	C16H19N3O3	Febrifugine	301.14	-2.6457	2.56	1.543	6	2	82	5	3	22	0
TCMC3170	C2CaO4	Calcium Oxalate	87.97965848	-1.8352	1.24	-1.65	4	0	80.26	1	0	6	0
TCMC3421	C15H12O4	Hydrangenol	256.0735589	-0.9997	2.67	3.342	2	2	66.76	1	3	19	0
TCMC4490	C10H8O4	7-Hydroxy-8-Methoxycoumarin,Daphnetin-8-Methyl Ether	192.0422587	-0.2698	2.12	0.375	1	1	46.53	1	2	14	0
TCMC4974	C20H20O4	Dichrin B,Licarin B	324.1361591	0.4817	3.22	4.809	0	0	36.92	3	4	24	0
TCMC5548	C16H19N3O3	Î‘-Dichroine	302.1504665	-3.7729	2.56	1.012	5	2	75.5	2	4	22	0

Download Data

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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: Dichroa febrifuga å¸¸å±±

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: TCMC5548

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC4974

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC4490

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3421

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3170

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2393

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2232

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC1991

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC1034

Occurrence of the ingredient across TCM components

Properties

Download Data