Compound Summary


  Compound Information

药名:

Peucedanocoumarin II

别名:

[(9R,10R)-9-acetoxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[6,5-h]chromen-10-yl] (E)-2-methylbut-2-enoate; (E)-2-methylbut-2-enoic acid [(9R,10R)-9-acetoxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[6,5-h]chromen-10-yl] ester; SpecPlus_000914; Spectrum2_000745; SPBio_000730; [(9R,10R)-9-acetoxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[6,5-h]chromen-10-yl] 2-methylbut-2-enoate; 2-methylbut-2-enoic acid [(9R,10R)-9-acetoxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[6,5-h]chromen-10-yl] ester; Spectrum4_001856; (E)-2-methylbut-2-enoic acid [(9R,10R)-9-acetoxy-2-keto-8,8-dimethyl-9,10-dihydropyrano[6,5-h]chromen-10-yl] ester; BSPBio_003339; [(9R,10R)-9-acetyloxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[6,5-h]chromen-10-yl] (E)-2-methylbut-2-enoate; Spectrum_001512; [(9R,10R)-9-acetyloxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[6,5-h]chromen-10-yl] 2-methylbut-2-enoate; ZINC03984029; Spectrum5_000392; KBioSS_001992; KBio2_001992; KBio2_004560; SPECTRUM1504160; MEGxp0_001932; peucedanocoumarin ii; SDCCGMLS-0066830.P001; KBioGR_002293; DivK1c_007010; KBio2_007128; KBio3_002559; Spectrum3_001640; KBio1_001954; 2-methylbut-2-enoic acid [(9R,10R)-9-acetoxy-2-keto-8,8-dimethyl-9,10-dihydropyrano[6,5-h]chromen-10-yl] ester

分子式:

C21H22O7

Smiles:

CC=C(C)C(=O)OC1C(C(OC2=C1C3=C(C=C2)C=CC(=O)O3)(C)C)OC(=O)C

成分:

HBIN039381

OB_score:

63.478989

SymMap_id:

SMIT13785;SMIT17152

TCMID_id:

17016

TCMSP_id:

MOL013087

PubChem_id:

5320509


   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
TCMBANKHE008512 radix Peucedani 前胡 To dispel wind and remove heat, and to relieve cough and resolve phlegm ./Cough, externally contracted wind-heat, lung heat phlegm depression, cough and asthma with abundant phlegm, sticky phlegm, retching counterflow and reduced food intake, fullness and oppression in chest and diaphragm.
TCMBANKHE007994 Herba Humuli Scandentis;Rhaponticum carthamoides 葎草 1. Diurectic. 2. Bacteriostatic. Flower and fruit inhibit the growth of Bacillus tuberculosis and its alcoholic infusion of stemsand leaves inhibits that of gram-positive bacteria in vitro. ;To boost qi and fortify spleen, quiet spirit./Tuberculosis, cystitis, mastitis, tonsillitis, lung heat cough, pulmonary welling abscess, vacuity heat with vexation and thirst, heat strangury, edema, inhibited urination, damp-heat diarrhea dysentery, heat toxin sores, itchy skin.
TCMBANKHE008462 Peucedanum govanianum var. bicolo 丽江前胡;漓江前胡

   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
TCMBANKGE000121 KCNH2 ERG-1; ERG1; H-ERG; HERG; HERG1; Kv11.1; LQT2; SQT1 potassium voltage-gated channel subfamily H member 2
TCMBANKGE000181 PIM1 PIM Pim-1 proto-oncogene, serine/threonine kinase
TCMBANKGE000201 ESR1 ER; ESR; ESRA; ESTRR; Era; NR3A1 estrogen receptor 1
TCMBANKGE000205 NOS2 HEP-NOS; INOS; NOS; NOS2A nitric oxide synthase 2
TCMBANKGE000286 GSK3B - glycogen synthase kinase 3 beta
TCMBANKGE000474 NCOA1 F-SRC-1; KAT13A; RIP160; SRC1; bHLHe42; bHLHe74 nuclear receptor coactivator 1
TCMBANKGE000701 ESR2 ER-BETA; ESR-BETA; ESRB; ESTRB; Erb; NR3A2; ODG8 estrogen receptor 2
TCMBANKGE000813 DPP4 ADABP; ADCP2; CD26; DPPIV; TP103 dipeptidyl peptidase 4
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