Compound Summary

  Compound Information

TCMBANKIN058950

药名:	Benzoylacetone
别名:	2-Propanone, benzoyl-; ST5197366; B11907_ALDRICH; Acetoacetophenone; 1-Phenyl-1,3-butanedione; Acetylbenzoylmethane; .alpha.-Acetylacetophenone; 1-Benzoyl-2-propanone; 1,3-BUTANEDIONE,1-PHENYL BENZOYLACETONE; AI3-10572; Benzoyl-aceton [German]; NSC100655; EINECS 202-286-4; InChI=1/C10H10O2/c1-8(11)7-10(12)9-5-3-2-4-6-9/h2-6H,7H2,1H; NSC4015; alpha-Acetylacetophenone; 4-07-00-02151 (Beilstein Handbook Reference); 1,3-Butanedione, 1-phenyl-; 1-Phenylbutane-1,3-dione; 1-Phenyl-1,3-butanedion; NSC 4015; BRN 0742413; 12830_FLUKA; 2-Acetylacetophenone; 93-91-4; 1-Benzoylacetone; 1-phenyl-1,3-butanedion; KS-00000C21; CVBUKMMMRLOKQR-UHFFFAOYSA-N; X6797; benzoyl acetone; BG00601093; Benzoyl-aceton [German]; SBB040798; NSC4015; 1-phenyl-butane-1,3-dione; omega-ACETYLACETOPHENONE; DSSTox_RID_76337; NSC 4015; 2-Acetylacetophenone; 2-Propanone, benzoyl-; NSC-100655; acetyl acetophenone; KB-64903; Acetylbenzoylmethane; DSSTox_CID_1803; .alpha.-Acetylacetophenone; ST24038177; AC1Q5F12; STR01075; MCULE-5543155182; alpha-Acetylacetophenone; AK161752; MolPort-000-667-917; 1,3-Butanedione, 1-phenyl-; Tox21_202879; 1-Phenyl-1,3-butanedion; MFCD00008786; UNII-I3RUV8U115; ZINC100006468; BG01501130; 93-91-4; 1-Benzoylacetone; I3RUV8U115; Benzoyl-aceton; 1-phenyl-1,3-butandione; 1-phenyl-3-butanedione; DSSTox_GSID_21803; AC1Q1K1U; B-0690; Acetoacetophenone; I01-6186; SC-23803; NCGC00260425-01; ST092313; 1-Benzoyl-2-propanone; NSC-4015; AI3-10572; CHEMBL3186793; ACMC-209ro2; ACT07622; BB_SC-0115; EINECS 202-286-4; DB-010994; 4-07-00-02151 (Beilstein Handbook Reference); RTR-030564; 1-Phenyl-1,3-butanedione, 99%; F3098-2657; PS-3611; AN-42671; 1-phenyl-butane-1,3 dione; BRN 0742413; BBL011014; TR-030564; 3-butanedione,1-phenyl-1; AC1L1O5P; NE10611; Benzoylacetone, 98% 50g; AKOS000119529; J-802021; CAS-93-91-4; SCHEMBL15116; LS-45895; ANW-40128; DTXSID3021803; NSC100655; 1-Phenyl-1,3-butanedione, purum, >=98.0% (GC); InChI=1/C10H10O2/c1-8(11)7-10(12)9-5-3-2-4-6-9/h2-6H,7H2,1H; FT-0622746; 1-Phenylbutane-1,3-dione; AB1003648; 1-PHENYL-1,3-BUTANEDIONE; Benzoylacetone; TRA0002644; STK802149
分子式:	C10H10O2
Smiles:	CC(=O)CC(=O)C1=CC=CC=C1
成分:	HBIN017808;HBIN002972
OB_score:	28.106709
CAS_id:	93-91-4
SymMap_id:	SMIT10145;SMIT17171
TCMID_id:	17084
TCMSP_id:	MOL008945
PubChem_id:	7166

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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

TCMBANKHE000744		北五味子
TCMBANKHE003746	Radix Scutellariae	黄芩			To remove damp-heat, to quench fire and counteract toxicity, to arrest bleeding, and to prevent abortion./Chest oppression with retching, diarrhea, jaundice, lung heat cough, infection of upper respiratory tract, acute tonsillitis, acute pharyngolaryngitis, ardent fever with vexation and thirst, blood heat, blood ejection, spontaneous external bleeding, swelling toxin of welling abscess and sore, stirring fetus in pregnancy.
TCMBANKHE006914	Ramulus Euonymi	鬼箭羽			For activating blood and modulating period/Concretion and conglomeration, pain in heart and abdomen, amenorrhea, dysmenorrhea, postpartum stasis stagnation abdominal pain, retention of lochia, mounting qi , joint running impediment pain, swelling of sores, painful wound from knocks and falls, burns and scalds, poisonous snake bite.
TCMBANKHE006493	Schisandra chinensis	五味子			To promote contraction and secure astriction, boost qi and engender liquid, quiet heart and spirit./Enduring cough and vacuity asthma, dream emission, frequent urination and enuresis, incessant chronic diarrhea, spontaneous sweating and night sweating, fluid damage and thirst, palpitation and insomnia.
TCMBANKHE008359	Semen Oroxyli	木蝴蝶			To remove heat from the lung and relieve sore throat, and to regulate the flow of qi of the liver and the stomach./Lung heat cough, throat impediment, aphonia, liver stomach qi pain.

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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

TCMBANKGE000181	PIM1	PIM	Pim-1 proto-oncogene, serine/threonine kinase
TCMBANKGE000201	ESR1	ER; ESR; ESRA; ESTRR; Era; NR3A1	estrogen receptor 1
TCMBANKGE000204	CXCL8	GCP-1; GCP1; IL8; LECT; LUCT; LYNAP; MDNCF; MONAP; NAF; NAP-1; NAP1; SCYB8	C-X-C motif chemokine ligand 8
TCMBANKGE000360	CCNA2	CCN1; CCNA	cyclin A2
TCMBANKGE000701	ESR2	ER-BETA; ESR-BETA; ESRB; ESTRB; Erb; NR3A2; ODG8	estrogen receptor 2
TCMBANKGE000784	CALM3	CALM; CAM1; CAM2; CAMB; CPVT6; CaM; CaMIII; HEL-S-72; LQT16; PHKD; PHKD3	calmodulin 3
TCMBANKGE001073	PTGS2	COX-2; COX2; GRIPGHS; PGG/HS; PGHS-2; PHS-2; hCox-2	prostaglandin-endoperoxide synthase 2
TCMBANKGE004266	AR	AIS; AR8; DHTR; HUMARA; HYSP1; KD; NR3C4; SBMA; SMAX1; TFM	androgen receptor