Compound Summary

  Compound Information

TCMBANKIN059002

药名:	Grayanotoxin I
别名:	ACon0_000384; 135912-EP2277880A1; MEGxp0_001761; Acetylandromedol; (3beta,6beta,14R)-Grayanotoxane-3,5,6,10,14,16-hexol, 14-acetate; G-I; NP-010017; NCGC00168796-02_C22H36O7_Grayanotoxane-3,5,6,10,14,16-hexol, 14-acetate, (3beta,6beta,14R,16alpha)-; GRAYANOTOXIN I; ZINC3978484; NCGC00168796-01; Grayanotoxane-3,5,6,10,14,16-hexol 14-acetate; 4720/9/6; SCHEMBL3229044; GTX-I; 7,9a-Methano-9aH-cyclopenta(b)heptalene-2,4,8,11,11a,12(1H)-hexol-, dodecahydro-1,1,4,8-tetramethyl-, 12-acetate, (2S,3aS,4aR,7R,8R,9aS,11R,11aR,12R)-; HSDB 3463; 135912-EP2292610A1; Rhodotoxine; Rhodotoxin; Asebotoxin; W4E6HC3T2B; BRN 2065643; Perhydro-2beta,4alpha,8alpha,11beta,11abeta-pentahydroxy-1,1,4,8-tetramethyl-7,9a-methano-9aalphaH-cyclopenta(b)heptalen-12beta-yl acetat; Andromedotoxin; UNII-W4E6HC3T2B; CHEMBL3085397; Grayanotoxane-3,5,6,10,14,16-hexol, 14-acetate, (3beta,6beta,14R)- (9CI); ACon1_000099; AKOS027326735; CHEBI:5542; AK322338; Perhydro-2beta,4alpha,8alpha,11beta,11abeta-pentahydroxy-1,1,4,8-tetramethyl-7,9a-methano-9aalphaH-cyclopenta(b)heptalen-12beta-yl acetate; 7,9a-Methano-9aH-cyclopenta(b)heptalene-2,4,8,11,11a,12(1H)-hexol, dodecahydro-1,1,4,8-tetramethyl-, 12-acetate (2S,3as,4R,4ar,7R,8R,9as,11R,11aR,12R)-; NSC 26711; (14R)-3beta,5,6beta,10,16-pentahydroxygrayanotoxan-14-yl acetate; C09103; 4720-09-6
分子式:	C22H36O7
Smiles:	CC(=O)OC1C2CCC3C1(CC(C4(C(C3(C)O)CC(C4(C)C)O)O)O)CC2(C)O
成分:	HBIN028404; HBIN042280; HBIN016025
OB_score:	60.55221
CAS_id:	4720-09-06
SymMap_id:	SMIT13188; SMIT02193; SMIT01270; SMIT06937
TCMID_id:	8992; 24581; 1161
TCMSP_id:	MOL012436; MOL005136
PubChem_id:	9548612

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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

TCMBANKHE000239	Rhododendron przewalskii	龙树杜鹃			To clear lung, relieve cough and transform phlegm./Cough and asthma, abundant and sticky phlegm.
TCMBANKHE000786		苦楝子
TCMBANKHE000810	Radix Zanthoxyli	两面针			To promote the flow of qi, relieve pain, to eliminate blood stasis, to promote blood circulation and dispel wind./Treatment of traumatic injury, rheumatic arthralgia, stomach-ache, teethache, bitten by venomous snake, applied for burn caused by hot liquid or fire.
TCMBANKHE001035	Rhododendron metternichii var. hondoese
TCMBANKHE003952	Folium Rhododendri Daurici	满山红			Acute bronchitis, chronic bronchitis.
TCMBANKHE007954	Flos Rhododendri Mollis	闹羊花			To relieve rheumatic conditions, and to eliminate blood stasis and alleviate pain./Tachycardia, palpitation, hypertension, wind-damp impediment pain, knocks and falls, intractable lichen.
TCMBANKHE007795	Herba Selaginellae	卷柏			To promote blood circulation and to stimulate menstrual discharge.Herba Selaginellae (carbonized) To remove blood stasis and to arrest bleeding./Amenorrhea, concretion and conglomeration, knocks and falls, abdominal pain, asthma (raw), blood ejection, hematuria, hematochezia, prolapse of rectum (scorch-fry).
TCMBANKHE007314	Rhododendron micranthum	照山白			To relieve cough and transform phlegm, dispel wind and free network vessels, regulate menstruation and relieve pain./Cough and asthma with abundant phlegm, wind-damp impediment pain, lumbago, menstrual disorder, dysmenorrhea, fracture.
TCMBANKHE009093	Leucothoe grayana	木藜芦
TCMBANKHE006443/YEM-263	Rhododendron simsii|Rhododendron simsii Planch.	杜鹃花叶|杜鹃	杜鹃	云南民族药物志：第二卷	To clear heat and resolve toxin, stanch bleeding./Swollen welling abscess and clove sores, bleeding due to external injury, urticaria.	佤族
TCMBANKHE005187/YEM-263	Rhododendron simsii|Rhododendron simsii Planch.	杜鹃花|杜鹃	杜鹃	云南民族药物志：第二卷	To harmonize blood, regulate menstruation, relieve cough, dispel wind-damp, resolve sore toxin./Blood ejection, spontaneous external bleeding, flooding and spotting, menstrual disorder, cough, wind-damp impediment pain, sore toxin of welling abscess and boil.	佤族

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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

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   化合物对应的靶点

靶点ID	基因名	基因别名	描述

TCMBANKGE000201	ESR1	ER; ESR; ESRA; ESTRR; Era; NR3A1	estrogen receptor 1
TCMBANKGE004266	AR	AIS; AR8; DHTR; HUMARA; HYSP1; KD; NR3C4; SBMA; SMAX1; TFM	androgen receptor