Compound Summary


  Compound Information

药名:

Isooctane

别名:

34862_SIAL; ISO-OCTANE; c1078; 34499_RIEDEL; 32291_RIEDEL; BRN 1696876; Pentane, 2,2,4-trimethyl-; NSC39117; 59045_FLUKA; 2,2,4-Trimethylpentane; InChI=1/C8H18/c1-7(2)6-8(3,4)5/h7H,6H2,1-5H; WLN: 1Y1&1X1&1&1; EINECS 208-759-1; 4-01-00-00439 (Beilstein Handbook Reference); 59030_FLUKA; 258776_ALDRICH; Isobutyltrimethylmethane; 31921-36-5; 360597_SIAL; 2,4,4-Trimethylpentane; 650439_ALDRICH; 59041_FLUKA; 360066_ALDRICH; HSDB 5682; 540-84-1; 155012_SIAL; AI3-23976; NSC 39117

分子式:

C8H18

Smiles:

CC(C)CC(C)(C)C

成分:

HBIN030995

OB_score:

60.28649

CAS_id:

31921-36-5

SymMap_id:

SMIT03163

TCMSP_id:

MOL000606

PubChem_id:

10907


   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
TCMBANKHE009036 Cacumen et Folium Biotae 侧柏叶 To arrest bleeding by removing heat from blood, and to promote the growth of black hair./Hemoptysis, duodenal bleeding, chronic bronchitis, tuberculosis, blood ejection, spontaneous external bleeding, hematuria, hematochezia, blood dysentery, incessant flooding and spotting, cough with profuse phlegm, wind-damp impediment pain, erysipelas, epidemic parotitis, scalds, burns.
TCMBANKHE005377/YEM-788 Herba Eupatorii|Eupatorium fortunei Turcz. 佩兰 水泽兰 云南民族药物志:第四卷 To resolve damp, invigorate the function of the spleen and improve appetite by its spicy fragrance, and to expel summer heat from the body surface./Nausea and vomiting, bad breath, drooling, distended head and oppression in chest, sweet-greasy in mouth, summerheat-damp exterior syndrome. 阿昌族/傣族/德昂族/哈尼族/基诺族/景颇族/拉祜族/傈僳族/苗族/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
TCMBANKGE000766 ACHE ACEE; ARACHE; N-ACHE; YT acetylcholinesterase (Cartwright blood group)
TCMBANKGE000813 DPP4 ADABP; ADCP2; CD26; DPPIV; TP103 dipeptidyl peptidase 4
TCMBANKGE006339 CA2 CA-II; CAC; CAII; Car2; HEL-76; HEL-S-282 carbonic anhydrase 2
TCMBANKGE008718 PRSS3 MTG; PRSS4; T9; TRY3; TRY4 serine protease 3
TCMBANKGE011079 PRSS1 TRP1; TRY1; TRY4; TRYP1 serine protease 1
TCMBANKGE014015 BCHE BCHED; CHE1; CHE2; E1 butyrylcholinesterase
TCMBANKGE014050 GABRA1 ECA4; EIEE19; EJM; EJM5 gamma-aminobutyric acid type A receptor subunit alpha1