TCM-ID Component

Component: Helleborus thibetanus 铁筷子

Description of the Component

Component ID	TCMH2107
Latin Name	Helleborus thibetanus
English Name	Tibetan hellebore
Chinese Pinyin Name	Tie Kuai Zi
中文名	铁筷子
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	GBVJ600-11, GBVJ601-11
Barcode Source	BOLDSYSTEMS

TCM Prescriptions with the Component

Prescription ID	Prescription English Name	Prescription Chinese Name
TCMFx7011	Shang Granulesng Spray	伤科灵喷雾剂

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
TCMT1221	Human herpesvirus 4

Ingredient Structrues

Ingredient ID: TCMC2771
Formula: C30H50O

Common Name	Cycloeucalenol
IUPAC Name	n.a.
Canonical SMILES	C=C(C(C)C)CC[C@H]([C@H]1CC[C@@]2([C@]1(C)CC[C@@]13[C@H]2CC[C@@H]2[C@]3(C1)CC[C@@H]([C@H]2C)O)C)C
Standard InCHI	InChI=1S/C30H50O/c1-19(2)20(3)8-9-21(4)23-12-14-28(7)26-11-10-24-22(5)25(31)13-15-29(24)18-30(26,29)17-16-27(23,28)6/h19,21-26,31H,3,8-18H2,1-2,4-7H3/t21-,22+,23-,24+,25+,26+,27-,28+,29-,30+/m1/s1
Standard InCHIKey	HUNLTIZKNQDZEI-PGFZVWMDSA-N
External Identifiers	ChEMBL [CHEMBL225634]; PubChem [101690];
Reference of Component-Ingredient Pair	22481107

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1578	Eleusine indica	Niu Jin Cao	牛筋草
TCMH2107	Helleborus thibetanus	Tie Kuai Zi	铁筷子
TCMH445	Hypericum japonicum	Di Er Cao	地耳草
TCMH348	Lobelia chinensis	Da Ban Bian Lian	大半边莲
TCMH2267	Periploca sepium	Xiang Jia Pi	香加皮
TCMH122	Lobelia chinensis	Ban Bian Lian	半边莲

Ingredient ID: TCMC2605
Formula: C31H52O

Common Name	n.a.
IUPAC Name	n.a.
Canonical SMILES	C=C(C(C)C)CC[C@H]([C@H]1CC[C@@]2([C@]1(C)CC[C@@]13[C@H]2CC[C@@H]2[C@]3(C1)CC[C@@H](C2(C)C)O)C)C
Standard InCHI	InChI=1S/C31H52O/c1-20(2)21(3)9-10-22(4)23-13-15-29(8)25-12-11-24-27(5,6)26(32)14-16-30(24)19-31(25,30)18-17-28(23,29)7/h20,22-26,32H,3,9-19H2,1-2,4-8H3/t22-,23-,24+,25+,26+,28-,29+,30-,31+/m1/s1
Standard InCHIKey	BDHQMRXFDYJGII-UEBIAWITSA-N
External Identifiers	ChEMBL [CHEMBL376350]; PubChem [94204];
Reference of Component-Ingredient Pair	26935127

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1578	Eleusine indica	Niu Jin Cao	牛筋草
TCMH1186	Lycium chinense	Gou Qi Zi	枸杞子
TCMH1542	Radix adenophorae	Nan Sha Shen	南沙参
TCMH1212	Melia azedarach	Ku Lian Zi	苦楝子
TCMH2107	Helleborus thibetanus	Tie Kuai Zi	铁筷子
TCMH1766	Sparganium stoloniferum	San Ling	三棱
TCMH1448	Mangifera indica	Mang Guo Ye	芒果叶
TCMH1185	Lycium chinense	Gou Qi	枸杞
TCMH310	Melia azedarach	Chuan Lian	川楝
TCMH1211	Melia azedarach	Ku Lian Pi	苦楝皮

Properties

Ingredient ID	Formulae	Name	MW	AlogP	MlogP	XlogP	# HBA	# HBD	PSA	# Rotatable Bond	# Ring	# Heacy Atom	Lipinski RO5 Violation
TCMC2605	C31H52O		440.4	2.633	4.76	12.365	1	1	20.23	13	5	32	1
TCMC2771	C30H50O	Cycloeucalenol	426.39	1.9488	4.65	11.97	1	1	20.23	12	5	31	1

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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.)