TCM-ID Component

Component: Thlaspi arvense 北败酱

Description of the Component

Component ID	TCMH139
Latin Name	Thlaspi arvense
English Name	dahurian patrinia herb
Chinese Pinyin Name	Bei Bai Jiang
中文名	北败酱
TCM Properties
TCM Meridians
Therapeutic Class English
Therapeutic Class Chinese
Functions
Toxicity	NA
Geo-authentic habitats (道地产区)	NA
Reference	Chinese Pharmacopoeia (2015)
Barcode ID	MKPCH570-09
Barcode Source	BOLDSYSTEMS

TCM Prescriptions with the Component

Prescription ID	Prescription English Name	Prescription Chinese Name
TCMF3287	Gong Yan Kang Granules	宫炎康颗粒
TCMF5375	Re Yan Ning Infusion	热炎宁冲剂
TCMF866	Re Yan Ning Tablet	热炎宁片
TCMF6362	Yi Dan Yan Recipe	胰胆炎合剂
TCMFx321	Zhi Tong Hua Zheng Capsule	止痛化症胶囊
TCMFx320	Zhi Tong Hua Zheng Tablet	止痛化症片

Targeted Human Proteins by the Ingredient of Component

Target ID	Gene Symbol	Target Name	Target Class	Uniprot ID
TCMT101	PTPN1	Protein-tyrosine phosphatase 1B	Hydrolase	P18031
TCMT11	HIF1A	Hypoxia-inducible factor 1 alpha	Transcription factor	Q16665
TCMT116	OPRM1	Mu opioid receptor	GPCR	P35372
TCMT174	HSD11B1	11-beta-hydroxysteroid dehydrogenase 1	Oxidoreductase	P28845
TCMT2	MAPT	Microtubule-associated protein tau	Unclassified	P10636

Targeted Pathogenic Microbes by the Ingredient of Component

Target ID	Target Name
TCMT1465	Entamoeba histolytica

Ingredient Structrues

Ingredient ID: TCMC2040
Formula: C19H21NO4

Common Name	Salutaridine
IUPAC Name	n.a.
Canonical SMILES	COC1=C[C@@]23CCN([C@@H](C2=CC1=O)Cc1c3c(O)c(cc1)OC)C
Standard InCHI	InChI=1S/C19H21NO4/c1-20-7-6-19-10-16(24-3)14(21)9-12(19)13(20)8-11-4-5-15(23-2)18(22)17(11)19/h4-5,9-10,13,22H,6-8H2,1-3H3/t13-,19+/m1/s1
Standard InCHIKey	GVTRUVGBZQJVTF-YJYMSZOUSA-N
External Identifiers	ChEMBL [CHEMBL404097]; PubChem [5408233];
Reference of Component-Ingredient Pair	21475122

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH317	Capsella bursa-pastoris	Ci Cai	荠菜
TCMH2515	Papaver somniferum	Ying Su Ke	罂粟壳
TCMH74	Patrinia villosa	Bai Jiang	败酱
TCMH1680	Sinomenium acutum	Qing Feng Teng	青风藤
TCMH139	Thlaspi arvense	Bei Bai Jiang	北败酱
TCMH1090	Brassica juncea	Jie Zi	芥子
TCMH1512	Isatis indigotica	Mu Da Qing Ye	木大青叶
TCMH126	Isatis indigotica	Ban Lan	板蓝
TCMH127	Isatis indigotica	Ban Lan Gen	板蓝根
TCMH381	Isatis indigotica	Da Qing Ye	大青叶
TCMH1510	Isatis indigotica	Mu Ban Lan Gen	木板蓝根
TCMH1489	Papaver somniferum	Mi Ying Su Ke	蜜罂粟壳
TCMH2514	Papaver somniferum	Ying Su	罂粟

Ingredient ID: TCMC1436
Formula: C20H30O2

Common Name	Kaurenoic Acid
IUPAC Name	n.a.
Canonical SMILES	C=C1C[C@@]23C[C@H]1CC[C@H]3[C@]1([C@H](CC2)[C@@](C)(CCC1)C(=O)O)C
Standard InCHI	InChI=1S/C20H30O2/c1-13-11-20-10-7-15-18(2,16(20)6-5-14(13)12-20)8-4-9-19(15,3)17(21)22/h14-16H,1,4-12H2,2-3H3,(H,21,22)/t14-,15+,16+,18-,19-,20-/m1/s1
Standard InCHIKey	NIKHGUQULKYIGE-OTCXFQBHSA-N
External Identifiers	ChEMBL [CHEMBL489140]; PubChem [73062];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH600	Euonymus fortunei	Fu Fang Teng	扶芳藤
TCMH271	Clerodendrum trichotomum	Chou Wu Tong Ye	臭梧桐叶
TCMH2513	Rhododendron mucronulatum	Ying Shan Hong	映山红
TCMH2185	Acanthopanax gracilistylus	Wu Jia Pi	五加皮
TCMH213	Boschniakia rossica	Cao Cong Rong	草苁蓉
TCMH517	Angelica pubescens	Du Huo	独活
TCMH139	Thlaspi arvense	Bei Bai Jiang	北败酱
TCMH270	Clerodendrum trichotomum	Chou Wu Tong	臭梧桐
TCMH279	Angelica pubescens	Chuan Du Huo	川独活
TCMH2082	Acanthopanax gracilistylus	Teng Wu Jia Gen	藤五加根
TCMH2139	Acanthopanax gracilistylus	Tu Jia Pi	土加皮
TCMH2152	Acanthopanax gracilistylus	Tu Wu Jia	土五加

Ingredient ID: TCMC1350
Formula: C27H40O4

Common Name	Hydroxyprogesterone Caproate
IUPAC Name	[(8R,9S,10R,13S,14S,17R)-17-acetyl-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] hexanoate
Canonical SMILES	CCCCCC(=O)O[C@@]1(CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CCC2=CC(=O)CC[C@]12C)C(=O)C
Standard InCHI	InChI=1S/C27H40O4/c1-5-6-7-8-24(30)31-27(18(2)28)16-13-23-21-10-9-19-17-20(29)11-14-25(19,3)22(21)12-15-26(23,27)4/h17,21-23H,5-16H2,1-4H3/t21-,22+,23+,25+,26+,27+/m1/s1
Standard InCHIKey	DOMWKUIIPQCAJU-LJHIYBGHSA-N
External Identifiers	ChEMBL [CHEMBL1200848]; PubChem [169870];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1518	Chaenomeles sinensis	Mu Gua	木瓜
TCMH139	Thlaspi arvense	Bei Bai Jiang	北败酱

Properties

Ingredient ID	Formulae	Name	MW	AlogP	MlogP	XlogP	# HBA	# HBD	PSA	# Rotatable Bond	# Ring	# Heacy Atom	Lipinski RO5 Violation
TCMC1350	C27H40O4	Hydroxyprogesterone Caproate	428.29	-0.092	3.99	5.735	4	0	60.44	11	4	31	1
TCMC1436	C20H30O2	Kaurenoic Acid	302.22	1.3222	3.44	6.629	2	1	37.3	4	4	22	1
TCMC2040	C19H21NO4	Salutaridine	327.15	-0.6163	3	1.283	3	1	59	6	4	24	0

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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.)