Compound Summary


  Compound Information

药名:

kadsurin A

别名:

DTXSID50331992; ZINC4098815; NP-013719; ZINC04098815; AKOS032948266; MCULE-7963122128; (2S,3R,3aS,7aR)-2-(1,3-benzodioxol-5-yl)-3a,7a-dimethoxy-3-methyl-5-prop-2-enyl-3,7-dihydro-2H-1-benzofuran-6-one; kadsurin a; C10640; (2S,3R,3aS,7aR)-5-allyl-2-(1,3-benzodioxol-5-yl)-3a,7a-dimethoxy-3-methyl-3,7-dihydro-2H-benzofuran-6-one; 99340-07-5; CHEBI:6098; MolPort-006-668-512; 6(2H)-Benzofuranone,2-(1,3-benzodioxol-5- yl)-3,3a,7,7a-tetrahydro-3a,7a-dimethoxy-3- methyl-5-(2-propenyl)-,(2S,3R,3aS,7aR)-; CHEMBL37432; AC1L9DKW

分子式:

C21H24O6

Smiles:

c12c(OC([H])([H])O1)c([H])c([H])c([C@]3([H])[C@@]([H])(C([H])([H])[H])[C@@](OC([H])([H])[H])(C([H])=C(C([H])([H])C([H])=C([H])[H])C(=O)C4([H])[H])[C@]4(OC([H])([H])[H])O3)c2[H]

成分:

HBIN031725

OB_score:

56.825073

CAS_id:

99340-07-5

SymMap_id:

SMIT02947;SMIT16143

TCMID_id:

12010

TCMSP_id:

MOL000323

PubChem_id:

442885


   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
TCMBANKHE004773 Herba Pteridis multifidae 凤尾草 1. To clear heat and toxic material. 2. To cool the blood and stop bleeding./Dysentery, diarrhea, strangury-turbidity, vaginal discharge, jaundice, swelling toxin of clove sore, throat impediment with nipple moth, scrofula, parotitis, mastitis, ardent fever and convulsion, snake or insect bites, blood ejection, spontaneous external bleeding, hematuria, hematochezia, bleeding due to external injury.
TCMBANKHE006932 Caulis Piperis Kadsurae;Caulis Piperis futokadsurae 海风藤 To relieve rheumatic conditions./Wind-cold-damp impediment, aching sinews in limb joints, hypertonicity of sinews and vessels.
TCMBANKHE006045 Kadsura japonica 日本南五味子
TCMBANKHE005990/YNS-247/XU-205 Kadsura peltigera [Syn. Kadsura longipedunculata ]|Kadsura longipedunculata Finet et Gagnep.|Kadsura longipedunculata 长梗南五味子|南五味子 五香血藤 云南药材标准:第四册|广西省桂林市荔浦县蒲芦乡万福村 舒筋活血,温经止痛。用于肝肾虚弱,腰膝算酸软,风湿疼痛;跌倒损伤:痛经,月经不调;脘腹冷痛|To move qi, quicken blood, relieve pain./Qi stagnation abdominal distention, abdominal pain, stomachache, pain in sinews and bones, dysmenorrhea, knocks and falls, innominate toxin swelling.

   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
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
TCMBANKGE000309 SCN5A CDCD2; CMD1E; CMPD2; HB1; HB2; HBBD; HH1; ICCD; IVF; LQT3; Nav1.5; PFHB1; SSS1; VF1 sodium voltage-gated channel alpha subunit 5
TCMBANKGE000476 NCOA2 GRIP1; KAT13C; NCoA-2; SRC2; TIF2; bHLHe75 nuclear receptor coactivator 2
TCMBANKGE000701 ESR2 ER-BETA; ESR-BETA; ESRB; ESTRB; Erb; NR3A2; ODG8 estrogen receptor 2
TCMBANKGE000766 ACHE ACEE; ARACHE; N-ACHE; YT acetylcholinesterase (Cartwright blood group)
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
TCMBANKGE006339 CA2 CA-II; CAC; CAII; Car2; HEL-76; HEL-S-282 carbonic anhydrase 2