TCM-ID Component

Description of the Component

Component ID	TCMH474
Latin Name	Onosma paniculatum
English Name	Paniculate onosma
Chinese Pinyin Name	Dian Zi Cao
中文名	滇紫草
TCM Properties
TCM Meridians
Therapeutic Class English
Therapeutic Class Chinese
Functions
Toxicity	NA
Geo-authentic habitats (道地产区)	NA
Reference	CFDA
Barcode ID	KU853044
Barcode Source	GenBank

TCM Prescriptions with the Component

Prescription ID	Prescription English Name	Prescription Chinese Name
TCMF6915	Xiao Er Bao Tai Kang Granules	小儿宝泰康颗粒

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
TCMT176	SOAT1	Acyl coenzyme A:cholesterol acyltransferase 1	Transferase	P35610
TCMT2	MAPT	Microtubule-associated protein tau	Unclassified	P10636
TCMT263	SOAT2	Acyl coenzyme A:cholesterol acyltransferase 2	Transferase	O75908
TCMT69	THRB	Thyroid hormone receptor beta-1	Nuclear receptor	P10828

Targeted Pathogenic Microbes by the Ingredient of Component

Target ID	Target Name
TCMT1214	Enterococcus faecium
TCMT1218	Staphylococcus aureus
TCMT1229	Enterococcus faecalis

Ingredient Structrues

Ingredient ID: TCMC796
Formula: C21H24O7

Common Name	Beta-Hydroxyisovalerylshikonin
IUPAC Name	[(1R)-1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] 3-hydroxy-3-methylbutanoate
Canonical SMILES	O=C(CC(O)(C)C)O[C@@H](C1=CC(=O)c2c(C1=O)c(O)ccc2O)CC=C(C)C
Standard InCHI	InChI=1S/C21H24O7/c1-11(2)5-8-16(28-17(25)10-21(3,4)27)12-9-15(24)18-13(22)6-7-14(23)19(18)20(12)26/h5-7,9,16,22-23,27H,8,10H2,1-4H3/t16-/m1/s1
Standard InCHIKey	MXANJRGHSFELEJ-MRXNPFEDSA-N
External Identifiers	ChEMBL [CHEMBL397309]; PubChem [479502];
Reference of Component-Ingredient Pair	26865314

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH2706	Lithospermum erythrorhizon	Zi Cao	紫草
TCMH474	Onosma paniculatum	Dian Zi Cao	滇紫草
TCMH2315	Arnebia euchroma	Xin Jiang Zi Cao	新疆紫草

Ingredient ID: TCMC2547
Formula: C18H18O6

Common Name	Acetylalkannin
IUPAC Name	[(1S)-1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] acetate
Canonical SMILES	CC(=O)O[C@H](C1=CC(=O)c2c(C1=O)c(O)ccc2O)CC=C(C)C
Standard InCHI	InChI=1S/C18H18O6/c1-9(2)4-7-15(24-10(3)19)11-8-14(22)16-12(20)5-6-13(21)17(16)18(11)23/h4-6,8,15,20-21H,7H2,1-3H3/t15-/m0/s1
Standard InCHIKey	WNFXUXZJJKTDOZ-HNNXBMFYSA-N
External Identifiers	ChEMBL [CHEMBL112415]; PubChem [9967285];
Reference of Component-Ingredient Pair	29207110

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH2706	Lithospermum erythrorhizon	Zi Cao	紫草
TCMH474	Onosma paniculatum	Dian Zi Cao	滇紫草
TCMH2315	Arnebia euchroma	Xin Jiang Zi Cao	新疆紫草

Ingredient ID: TCMC2388
Formula: C21H22O6

Common Name	Beta,Beta-Dimethylacrylalkannin
IUPAC Name	[(1S)-1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] 3-methylbut-2-enoate
Canonical SMILES	CC(=CC[C@@H](C1=CC(=O)c2c(C1=O)c(O)ccc2O)OC(=O)C=C(C)C)C
Standard InCHI	InChI=1S/C21H22O6/c1-11(2)5-8-17(27-18(25)9-12(3)4)13-10-16(24)19-14(22)6-7-15(23)20(19)21(13)26/h5-7,9-10,17,22-23H,8H2,1-4H3/t17-/m0/s1
Standard InCHIKey	BATBOVZTQBLKIL-KRWDZBQOSA-N
External Identifiers	ChEMBL [CHEMBL513640]; PubChem [442720];
Reference of Component-Ingredient Pair	15337288

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH2706	Lithospermum erythrorhizon	Zi Cao	紫草
TCMH474	Onosma paniculatum	Dian Zi Cao	滇紫草
TCMH2315	Arnebia euchroma	Xin Jiang Zi Cao	新疆紫草

Ingredient ID: TCMC2069
Formula: C16H16O5

Common Name	Shikonin
IUPAC Name	5,8-dihydroxy-2-[(1R)-1-hydroxy-4-methylpent-3-enyl]naphthalene-1,4-dione
Canonical SMILES	CC(=CC[C@H](C1=CC(=O)c2c(C1=O)c(O)ccc2O)O)C
Standard InCHI	InChI=1S/C16H16O5/c1-8(2)3-4-10(17)9-7-13(20)14-11(18)5-6-12(19)15(14)16(9)21/h3,5-7,10,17-19H,4H2,1-2H3/t10-/m1/s1
Standard InCHIKey	NEZONWMXZKDMKF-SNVBAGLBSA-N
External Identifiers	ChEMBL [CHEMBL9470]; PubChem [479503];
Reference of Component-Ingredient Pair	19760501

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH2706	Lithospermum erythrorhizon	Zi Cao	紫草
TCMH474	Onosma paniculatum	Dian Zi Cao	滇紫草
TCMH2315	Arnebia euchroma	Xin Jiang Zi Cao	新疆紫草

Properties

Ingredient ID	Formulae	Name	MW	AlogP	MlogP	XlogP	# HBA	# HBD	PSA	# Rotatable Bond	# Ring	# Heacy Atom
TCMC796	C21H24O7	Beta-Hydroxyisovalerylshikonin	388.15	0.5562	3	1.167	5	3	121.13	14	2	28
TCMC2069	C16H16O5	Shikonin	288.1	0.0184	2.67	0.858	3	3	94.83	8	2	21
TCMC2388	C21H22O6	Beta,Beta-Dimethylacrylalkannin	370.14	1.8371	3.11	2.047	4	2	100.9	12	2	27
TCMC2547	C18H18O6	Acetylalkannin	330.11	0.3975	2.78	1.169	4	2	100.9	10	2	24

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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: Onosma paniculatum 滇紫草

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: TCMC796

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2547

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2388

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2069

Occurrence of the ingredient across TCM components

Properties

Download Data