TCM-ID Component

Description of the Component

Component ID	TCMH2500
Latin Name	Grevillea robusta
English Name	Robust silk oak
Chinese Pinyin Name	Yin Hua
中文名	银花
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	TDEF408-12
Barcode Source	BOLDSYSTEMS

TCM Prescriptions with the Component

Prescription ID	Prescription English Name	Prescription Chinese Name
TCMFx5293	Wai Yong Wu Di Ointment	外用无敌膏
TCMFx2865	Xin Jia Xiang Ru Decoction	新加香薷饮
TCMFx6907	Yin Huang Ruan Capsules	银黄软胶囊

Targeted Human Proteins by the Ingredient of Component

Target ID	Gene Symbol	Target Name	Target Class	Uniprot ID

Targeted Pathogenic Microbes by the Ingredient of Component

Target ID	Target Name
TCMT1176	Streptococcus pneumoniae
TCMT1217	Bacillus anthracis
TCMT1218	Staphylococcus aureus
TCMT1382	Plasmodium falciparum (isolate K1 / Thailand)
TCMT1438	Plasmodium falciparum

Ingredient Structrues

Ingredient ID: TCMC2433
Formula: C21H22O10

Common Name	Robustaside D
IUPAC Name	[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxyphenoxy)oxan-2-yl]methyl (E)-3-(1-hydroxy-4-oxocyclohexa-2,5-dien-1-yl)prop-2-enoate
Canonical SMILES	O=C(/C=C/C1(O)C=CC(=O)C=C1)OC[C@H]1O[C@@H](Oc2ccc(cc2)O)[C@@H]([C@H]([C@@H]1O)O)O
Standard InCHI	InChI=1S/C21H22O10/c22-12-1-3-14(4-2-12)30-20-19(27)18(26)17(25)15(31-20)11-29-16(24)7-10-21(28)8-5-13(23)6-9-21/h1-10,15,17-20,22,25-28H,11H2/b10-7+/t15-,17-,18+,19-,20-/m1/s1
Standard InCHIKey	KQIQKULTIAJZKL-VHFDLOJPSA-N
External Identifiers	ChEMBL [CHEMBL1667883]; PubChem [38358972];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH2500	Grevillea robusta	Yin Hua	银花

Ingredient ID: TCMC2361
Formula: C36H56O6

Common Name	Cylindrocyclophane A
IUPAC Name	n.a.
Canonical SMILES	CCCC[C@H]1CCCC[C@H](C)[C@@H](O)c2cc(O)c(c(c2)O)[C@H](CCCC[C@@H]([C@H](c2cc(c1c(O)c2)O)O)C)CCCC
Standard InCHI	InChI=1S/C36H56O6/c1-5-7-15-25-17-11-9-13-23(3)36(42)28-21-31(39)34(32(40)22-28)26(16-8-6-2)18-12-10-14-24(4)35(41)27-19-29(37)33(25)30(38)20-27/h19-26,35-42H,5-18H2,1-4H3/t23-,24-,25-,26-,35+,36+/m0/s1
Standard InCHIKey	JCKOOZUMKBNWSJ-WDCWCBICSA-N
External Identifiers	ChEMBL [CHEMBL1224866]; PubChem [10348304];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH2500	Grevillea robusta	Yin Hua	银花

Ingredient ID: TCMC2341
Formula: C20H13N3O

Common Name	6-Cyano-5-Methoxyindolo[2,3-A]Carbazole
IUPAC Name	5-methoxy-11,12-dihydroindolo[2,3-a]carbazole-6-carbonitrile
Canonical SMILES	COc1c2c([nH]c3c2cccc3)c2c(c1C#N)c1ccccc1[nH]2
Standard InCHI	InChI=1S/C20H13N3O/c1-24-20-13(10-21)16-11-6-2-4-8-14(11)22-18(16)19-17(20)12-7-3-5-9-15(12)23-19/h2-9,22-23H,1H3
Standard InCHIKey	ADLSFYJDHWUKFP-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL596128]; PubChem [131448];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH2500	Grevillea robusta	Yin Hua	银花

Ingredient ID: TCMC1291
Formula: C15H18O4

Common Name	Grossheimin
IUPAC Name	(3aR,4S,6aR,9S,9aR,9bR)-4-hydroxy-9-methyl-3,6-dimethylidene-3a,4,5,6a,7,9,9a,9b-octahydroazuleno[4,5-b]furan-2,8-dione
Canonical SMILES	C[C@@H]1C(=O)C[C@@H]2[C@H]1[C@H]1OC(=O)C(=C)[C@@H]1[C@H](CC2=C)O
Standard InCHI	InChI=1S/C15H18O4/c1-6-4-11(17)13-8(3)15(18)19-14(13)12-7(2)10(16)5-9(6)12/h7,9,11-14,17H,1,3-5H2,2H3/t7-,9+,11+,12+,13-,14-/m1/s1
Standard InCHIKey	YGMIBVIKXJJQQJ-MSOSQAFRSA-N
External Identifiers	ChEMBL [CHEMBL271958]; PubChem [442256];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH2500	Grevillea robusta	Yin Hua	银花

Properties

Ingredient ID	Formulae	Name	MW	AlogP	MlogP	XlogP	# HBA	# HBD	PSA	# Rotatable Bond	# Ring	# Heacy Atom	Lipinski RO5 Violation
TCMC1291	C15H18O4	Grossheimin	262.12	-0.1467	2.67	-0.156	4	1	63.6	2	3	19	0
TCMC2341	C20H13N3O	6-Cyano-5-Methoxyindolo[2,3-A]Carbazole	311.11	-0.8579	3.22	3.842	3	2	64.6	2	5	24	0
TCMC2361	C36H56O6	Cylindrocyclophane A	584.41	-3.8758	4.76	9.318	2	6	121.38	16	2	42	2
TCMC2433	C21H22O10	Robustaside D	434.12	-2.224	2.67	0.039	8	5	162.98	12	3	31	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.)

Component: Grevillea robusta 银花

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: TCMC2433

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2361

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2341

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC1291

Occurrence of the ingredient across TCM components

Properties

Download Data