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Compound Summary

Compound Information

TCMBANKIN061934

药名:	neoglucobrassicin
别名:	Neoglucobrassicin; 1-(Oxylatosulfonyloxyimino)-2-(1-methoxy 1H-indole-3-yl)ethyl 1-thio-beta-D-glucopyranoside; CHEBI:64965; neoglucobrassicin(1-); 1-S-[2-(1-methoxy-1H-indol-3-yl)-N-(sulfonatooxy)ethanimidoyl]-1-thio-beta-D-glucopyranose; neoglucobrassicin anion; beta-D-Glucopyranose, 1-thio-, 1-(1-methoxy-N-(sulfooxy)-1H-indole-3-ethanimidate); [[2-(1-methoxyindol-3-yl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]sulfanyl-ethylidene]amino] hydrogen sulfate; [[2-(1-methoxyindol-3-yl)-1-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]thio]ethylidene]amino] hydrogen sulfate; [[2-(1-methoxyindol-3-yl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl-ethylidene]amino] hydrogen sulfate; [[2-(1-methoxy-3-indolyl)-1-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]thio]ethylidene]amino] hydrogen sulfate; [[2-(1-methoxyindol-3-yl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylethylidene]amino] hydrogen sulfate
分子式:	C17H22N2O10S2
Smiles:	CON1C=C(C2=CC=CC=C21)CC(=NOS(=O)(=O)O)SC3C(C(C(C(O3)CO)O)O)O
成分:	HBIN036636; HBIN018071
OB_score:	1.943157
CAS_id:	5187-84-8
SymMap_id:	SMIT01531;SMIT04152; SMIT02706
TCMID_id:	15392
TCMSP_id:	MOL001795; MOL011112; MOL000017
PubChem_id:	9576416

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

TCMBANKHE001367	Semen Hyoscyami	天仙子			To relieve spasm and pain, and to cause tranquilization./1. Antisudorific, saliva antisecretory and mydriatic.2. Relaxing the smooth muscles.3. Increasing heart rate and exciting the respiratory center.
TCMBANKHE002149		楮实子
TCMBANKHE002776		白花菜子			Wind-cold sinew and bone numbness, aching pain in back and shoulder, lumbago, swelling pain due to external injury, bone tuberculosis, hemorrhoids and fistulas.
TCMBANKHE004707	Radix Paeoniae Rubra; Lignum Paeoniae Rubra	赤芍			To remove heat from blood, to eliminate blood stasis, and to relieve pain./1. Paeoniflorin, one of its active components, has a strong antispastic effect and also analgesic, sedative, anticonvulsive, antibacterial and anti-imflammatory effects. 2. Dilating blood vessels, increasing coronary flow and improving myocardial oxygen supply. 3. Inhibiting platelets aggregation.
TCMBANKHE007523	Folium Polygoni Tinctorii	蓼大青叶			To remove toxic heat, and to cause subsidence of eruptions by reducing heat in blood./Treatment of fever and eruptions in epidemic diseases, cough and asthma due to heat in the lung, inflammation of the throat, mnmps, erysipelas, carbuncle.
TCMBANKHE005678	Sisymbrium officinale	钻果蒜芥
TCMBANKHE008687	Rhizoma Anemarrhee	知母			To remove heat and quench fire, and to promote the production of body fluid and relieve dryness syndromes./Diabetes mellitus, warm heat disease, ardent fever with vexation and thirst, cough and asthma, dry cough, constipation, steaming bone tidal fever, vacuity vexation and insomnia, strangury-turbidity.
TCMBANKHE008546	Brassica napus	欧洲油菜
TCMBANKHE007733/YEM-310	Brassica oleracea var. gemmifera\|Brassica oleracea L. var. capitata L.	孢子甘蓝;抱子甘蓝\|莲花白	莲花白	云南民族药物志：第二卷		傣族
TCMBANKHE000468/YEM-310	Brassica oleracea var. botrytis subvar. cauliflora\|Brassica oleracea L. var. capitata L.	净化花椰菜\|莲花白	莲花白	云南民族药物志：第二卷		傣族
TCMBANKHE005786/YEM-310	Brassica oleracea var. gongylodes\|Brassica oleracea L. var. capitata L.	苤蓝\|莲花白	莲花白	云南民族药物志：第二卷		傣族
TCMBANKHE000936/YEM-310	Brassica oleracea var. botrytis subvar. cymosa\|Brassica oleracea L. var. capitata L.	聚散花椰菜\|莲花白	莲花白	云南民族药物志：第二卷		傣族
TCMBANKHE005203/YEM-999/XU-341	Radix Isatidis seu Baphicacanthi\|Isatis indigotica Fort.\|Isatis indigotica	板蓝根\|菘蓝	板蓝根	云南民族药物志：第五卷\|山东省菏泽市	To remove toxic heat, to reduce heat in blood, and to soothe sore throat./Epidemic encephalitis, measles papulis, parotitis, influenza, warm toxin macular eruption, ardent fever with headache, massive head scourge, throat pain, maculopapular eruption, epidemic parotitis, erysipelas, hepatitis, swelling toxin of sore and welling abscess.	回族/彝族
TCMBANKHE003869/YEM-999/XU-341	Folium Isatidis\|Isatis indigotica Fort.\|Isatis indigotica	板蓝根（大青叶）\|菘蓝	板蓝根	云南民族药物志：第五卷\|山东省菏泽市	To clear heat and toxic materials, cool blood and eliminate eruption./Acute parotitis, encephalitis, hepatitis, lung abscess, acute gastroenteritis, infection of upper respiratory tract, warm evil in construction, ardent fever with clouded spirit, macular eruption and papules, jaundice, heat dysentery, epidemic parotitis, throat impediment, erysipelas, swollen welling abscess.	回族/彝族

植物对应的疾病

疾病ID	病名	疾病类型	MeSH	参考文献

化合物对应的靶点

靶点ID	基因名	基因别名	描述

TCMBANKGE004266	AR	AIS; AR8; DHTR; HUMARA; HYSP1; KD; NR3C4; SBMA; SMAX1; TFM	androgen receptor
TCMBANKGE006339	CA2	CA-II; CAC; CAII; Car2; HEL-76; HEL-S-282	carbonic anhydrase 2