Compound Summary

  Compound Information

TCMBANKIN000067

药名:	Embelin
别名:	MFCD00016369; CS-1879; BS0074; CHEBI:4778; BDBM50078850; NCGC00017248-04; SCHEMBL148744; AKOS016010144; NCGC00025359-02; ZINC1531764; 2,5-Cyclohexadiene-1,4-dione, 2,5-dihydroxy-3-undecyl-; AIDS-009914; TNP00137; SBB005949; BRN 1885786; AC-542/20644009; Embelin, Embelia ribes; NCI60_042031; NCGC00017248-12!2,5-dihydroxy-3-undecylcyclohexa-2,5-diene-1,4-dione; HSCI1_000123; Embelin, Embelia ribes; C10342; AK115155; Apoptosis Activator III, Embelin; CCG-39906; NCGC00017248-06; BSPBio_003531; 2,5-Dihydroxy-3-undecyl-[1,4]benzoquinone; LS-40347; KBio2_004561; 4-08-00-02769 (Beilstein Handbook Reference); Embelin, >=98% (HPLC), powder; D05HSW; NSC 91874; DTXSID80203537; C17H26O4; MCULE-1558476181; KBio2_001993; 4CH-024635; C-52730; 550-24-3; V0365; embelin ; SR-01000597536; embelin; DivK1c_006597; SR-01000597536-1; KBio1_001541; EMBELIN; UNII-SHC6U8F5ER; SPECTRUM1504074; NCGC00017248-03; Embelic acid; SHC6U8F5ER; MolPort-000-165-323; Spectrum3_001931; KBioSS_001993; NSC-91874; 2,5-Dihydroxy-3-undecyl-p-benzoquinone; Tocris-2156; EINECS 208-979-8; MLS000563189; SpecPlus_000501; p-Benzoquinone,5-dihydroxy-3-undecyl-; AC1L1FFT; Spectrum5_000620; BIDD:ER0529; SMR000470851; NCGC00017248-07; 2,5-Cyclohexadiene-1,4-dione, 2,5-dihydroxy-3-undecyl- (9CI); XIAP inhibitor, Embelin; NCGC00025359-04; S7025; HY-17473; NCGC00025359-05; ST057212; 2,4-dione, 2,5-dihydroxy-3-undecyl-; NCGC00025359-03; HMS3268N13; NCGC00017248-08; KBio2_007129; ST24038748; NCGC00017248-05; KBioGR_002240; E1406_SIGMA; AIDS009914; Spectrum4_001760; HMS3652J16; 2,5-Dihydroxy-3-undecyl-2,5-cyclohexadiene-1,4-dione; AC1Q6BUE; HMS1922B07; HMS2271A03; 2,5-Dihydroxy-3-undecyl-1,4-benzoquinone; SR-01000597536-3; KB-225927; Emberine; Spectrum_001513; 2,5-dihydroxy-3-undecyl-1,4-benzochinon; KBio3_002783; SDCCGMLS-0066817.P001; NCGC00017248-02; NCGC00017248-10; NCGC00025359-01; CHEMBL221137; 2,5-dihydroxy-3-undecylcyclohexa-2,5-diene-1,4-dione; NSC91874; NCGC00017248-01; FT-0712499; 2,5-dihydroxy-3-undecyl-cyclohexa-2,5-diene-1,4-dione; p-Benzoquinone, 2,5-dihydroxy-3-undecyl-; IRSFLDGTOHBADP-UHFFFAOYSA-N
分子式:	C17H26O4
Smiles:	CCCCCCCCCCCC1=C(C(=O)C=C(C1=O)O)O
成分:	HBIN025026
OB_score:	37.718117
CAS_id:	550-24-3
SymMap_id:	SMIT07020;SMIT15236
TCMID_id:	6766
TCMSP_id:	MOL005235
PubChem_id:	3218

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   化合物对应的植物

植物ID	拉丁名	药用植物名	药名	来源	功能与主治	使用民族

TCMBANKHE000464	Rapanea neurophylla
TCMBANKHE001520	Rapanea umbellata	三华密花树
TCMBANKHE002156	Myrsine capitellata
TCMBANKHE002715	Semen Phaseoli Radiati	绿豆			1. To clear heat and toxic materials, clear summer-heat and promote diuresis. 2. To relieve the metallic and drug poisoning. 3. External use for clearing away heat and promoting tissue regeneration. 4. To reduce the level of blood-fat./1. Diuretic. 2. Its coat exerts a bacteriostatic effect on staphylococcus.
TCMBANKHE003726	Cortex Cinmomi	肉桂			To supplement body fire, reinforce yang, and lead the fire back to the kidney, to dispel cold and relieve pain, and to activate blood circulation and stimulate menstrual discharge./Impotence, uterus cold, cold pain in lumbus and knees, kidney vacuity asthma, yang vacuity dizziness, red eyes and sore pharynx, cold pain in heart and abdomen, vacuity cold vomiting and diarrhea, cold mounting, running piglet, amenorrhea, dysmenorrhea.
TCMBANKHE003814	Semen Pharbitidis	牵牛子			To cause drastic purgation for clearing away retained fluid, and to kill worms./Edema distention fullness, inhibited urine and stool, phlegm-rheum and accumulation-gathering, qi counterflow with cough and asthma, abdominal pain due to worm accumulation, ascariasis, taeniasis.
TCMBANKHE003819	Embelia oblongifolia	马桂花			To expel worms, check diarrhea./Taeniasis, diarrhea.
TCMBANKHE003855	Ardisia humilis	矮紫金牛
TCMBANKHE004074	Aegiceras corniculatum	蜡烛果
TCMBANKHE004154	Ardisiae japonicae	矮地茶			1. To eliminate phlegm and relieving cough.2. To promote diuresis to deprive dampness. 3. To activate blood circulation and stop bleeding./1. Bergenin, an active comonent, is an expectorant. 2. Its volatile oil or flavone can relieve bronchospasm induced by histamine in vitro. 3. Its decoction inhibits the growth of Pneumococcus, Staphylococcus aureus and influenza virus in vitro.
TCMBANKHE005002	Claviceps purpurea	麦角			To contract uterus and stanch bleeding, relieve pain./Postpartum bleeding, migraine.
TCMBANKHE005391	Ardisia colorata	有色紫金牛
TCMBANKHE008910	Semen Pharbitidis	牵牛子			To cause drastic purgation for clearing away retained fluid, and to kill worms./Edema distention fullness, inhibited urine and stool, phlegm-rheum and accumulation-gathering, qi counterflow with cough and asthma, abdominal pain due to worm accumulation, ascariasis, taeniasis.
TCMBANKHE005622		鸡矢藤			Wind-damp pain, diarrhea, dysentery, pain in stomach duct and abdomen, qi vacuity edema, heavy head and low food intake, liver spleen enlargement, scrofula, intestinal welling abscess, innominate toxin swelling, knocks and falls.
TCMBANKHE005958	Radix Clematidis	威灵仙			To relieve rheumatic conditions, to remove obstruction of collaterals, and to alleviate pain./Common cold, tonsillitis, acute icterohepatitis, laryngitis, rheumatic arthritis, wind-damp impediment pain, numbness in limbs, hypertonicity of sinews and vessels, bone stuck in throat.
TCMBANKHE008992	Embelia robusta	粗壮酸藤子
TCMBANKHE008246	Myrsine africana	铁子			To dispel wind and relieve pain, clear heat and disinhibit damp, promote contraction and stanch bleeding./Wind-damp impediment pain, toothache, diarrhea, dysentery, flooding, hematochezia, tuberculosis and hemoptysis.
TCMBANKHE005939/YEM-748	Ardisia japonica|Ardisia japonica(Hornst.)Blume	紫金牛	紫金牛	云南民族药物志：第四卷	To suppress cough, dispel phlegm, quicken blood, disinhibit urine, resolve toxin./Chronic trachitis, hepatitis, acute nephritis, chronic nephritis, tuberculosis and hemoptysis, blood ejection, dysentery, hypertension, mounting qi, taxation damage and strength desertion, aching sinews and bones, toxin swelling.	阿昌族/傣族/德昂族/景颇族/傈僳族/苗族/瑶族/壮族
TCMBANKHE004435/YEM-783	Embelia ribes|Embelia ribes Burm.f.	咸酸蔃|白花酸藤子	小花酸藤子	云南民族药物志：第四卷	To quicken blood and regulate menstruation, clear heat and disinhibit damp, resolve toxin and disperse swelling./Amenorrhea, dysentery, diarrhea, child head sore, itchy skin, knocks and falls, bleeding due to external injury, poisonous snake bite.	傣族/德昂族/哈尼族/基诺族/景颇族/傈僳族/佤族/彝族
TCMBANKHE005665/YNS-322/YEM-953/XU-212	Ardisia crenata|Ardisia crenata Sims	朱砂根	朱砂茎叶|朱砂根	云南药材标准：第四册|云南民族药物志：第五卷|广西省桂林市荔浦县蒲芦乡天河瀑布景区外	清热宁心，养血活血，利咽明目。用于口糜，咽喉肿痛，胁肋痞痛，视物模糊，心悸失眠；风湿痹痛，跌倒损伤|To clear heat and resolve toxin, quicken blood and relieve pain./Swelling pain in throat, wind-damp-heat impediment, jaundice, dysentery, knocks and falls, fire flow, mastitis, testitis.	阿昌族/傣族/德昂族/哈尼族/基诺族/景颇族/拉祜族/傈僳族/苗族/佤族/瑶族/彝族/壮族

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   植物对应的疾病

疾病ID	病名	疾病类型	MeSH	参考文献

TCMBANKDI000016	Charcot-Marie-Tooth Disease	disease	Congenital, Hereditary, and Neonatal Diseases and Abnormalities; Nervous System Diseases	31695036
TCMBANKDI000018	Pancreatic Neoplasm	disease	Digestive System Diseases; Neoplasms; Endocrine System Diseases	25128650
TCMBANKDI000022	Prostatic Neoplasms	group	Neoplasms; Male Urogenital Diseases	21565443
TCMBANKDI000085	Inflammation	phenotype	Pathological Conditions, Signs and Symptoms	25128650
TCMBANKDI001402	Precursor T-Cell Lymphoblastic Leukemia-Lymphoma	disease	Neoplasms; Immune System Diseases; Hemic and Lymphatic Diseases	29170254
TCMBANKDI007361	Multiple Myeloma	disease	Neoplasms; Immune System Diseases; Hemic and Lymphatic Diseases; Cardiovascular Diseases	21565443
TCMBANKDI008514	Carcinoma	group	Neoplasms	25974735
TCMBANKDI015452	Thyroid Neoplasm	disease	Neoplasms; Endocrine System Diseases	25974735
TCMBANKDI023714	Carcinoma, Papillary	disease	Neoplasms	25974735
TCMBANKDI031985	Brain Ischemia	disease	Nervous System Diseases; Cardiovascular Diseases	21709246

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   化合物对应的靶点

靶点ID	基因名	基因别名	描述

TCMBANKGE000240	IL17A	CTLA-8; CTLA8; IL-17; IL-17A; IL17	interleukin 17A
TCMBANKGE000284	YARS1	CMTDIC; TYRRS; YARS; YRS; YTS	tyrosyl-tRNA synthetase 1
TCMBANKGE000705	GPR84	EX33; GPCR4	G protein-coupled receptor 84
TCMBANKGE000706	ARG1	-	arginase 1
TCMBANKGE000774	PRRT2	BFIC2; BFIS2; DSPB3; DYT10; EKD1; FICCA; ICCA; IFITMD1; PKC	proline rich transmembrane protein 2
TCMBANKGE001063	CEBPB	C/EBP-beta; IL6DBP; NF-IL6; TCF5	CCAAT enhancer binding protein beta
TCMBANKGE001114	IL6	BSF-2; BSF2; CDF; HGF; HSF; IFN-beta-2; IFNB2; IL-6	interleukin 6
TCMBANKGE001156	CASP3	CPP32; CPP32B; SCA-1	caspase 3
TCMBANKGE001165	XIAP	API3; BIRC4; IAP-3; ILP1; MIHA; XLP2; hIAP-3; hIAP3	X-linked inhibitor of apoptosis
TCMBANKGE001177	TP53	BCC7; BMFS5; LFS1; P53; TRP53	tumor protein p53
TCMBANKGE001178	STAT3	ADMIO; ADMIO1; APRF; HIES	signal transducer and activator of transcription 3