Compound Summary


  Compound Information

药名:

Isoamyl benzoate

别名:

1-Butanol, 3-methyl-, benzoate; Isopentyl alcohol, benzoate; FEMA No. 2058; 94-46-2; ST5410287; 54846-63-8; EINECS 202-334-4; Isoamyl benzoate (natural); BRN 1946447; Benzoic acid, 3-methylbutyl ester; 3-Methylbutyl benzoate; benzoic acid isoamyl ester; InChI=1/C12H16O2/c1-10(2)8-9-14-12(13)11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H; WLN: 1Y1&2OVR; AI3-01966; benzoic acid isopentyl ester; 3-Methyl-1-butyl benzoate; W205818_ALDRICH; Benzoic acid, 1-(3-methyl)butyl ester; Isopentyl alcohol, benzoate (6CI,8CI); 4-09-00-00292 (Beilstein Handbook Reference); Isopentyl benzoate; 1-(3-Methyl)butyl benzoate; NSC9284; Benzoic acid, isopentyl ester; NSC 9284

分子式:

C12H16O2

Smiles:

CC(C)CCOC(=O)C1=CC=CC=C1

成分:

HBIN030414

OB_score:

52.198738

CAS_id:

94-46-2

SymMap_id:

SMIT11317

TCMSP_id:

MOL010257

PubChem_id:

7193


   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
TCMBANKHE004699 fructus hippophae 沙棘
TCMBANKHE006660 Ramulus Cinmomi 桂枝 To induce perspiration, to warm the channels and stimulate menstrual discharge, to reinforce yang, to relieve palpitation, and to promote the descending of qi./Wind-cold exterior syndrome, cold-damp impediment pain, reversal cold of limbs, amenorrhea and dysmenorrhea, concretion and conglomeration, chest impediment, palpitation, phlegm-rheum, inhibited urination.
TCMBANKHE004643/YEM-590/XU-716 Folium Mori|Morus alba L.|Morus alba 桑叶|桑 桑叶 云南民族药物志:第三卷|云南省昭通市盐津县 To dispel wind-heat and to remove heat from the lung, to subdue hyperactivity of the liver and improve eyesight./Wind-heat common cold, lung heat dry cough, dizziness and headache, red eyes and clouded vision. 阿昌族/布依族/傣族/德昂族/哈尼族/景颇族/傈僳族/苗族/水族/佤族/彝族/藏族

   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
TCMBANKGE000633 ADRB2 ADRB2R; ADRBR; B2AR; BAR; BETA2AR adrenoceptor beta 2
TCMBANKGE003157 CHRM2 HM2 cholinergic receptor muscarinic 2
TCMBANKGE005535 CHRM1 HM1; M1; M1R cholinergic receptor muscarinic 1
TCMBANKGE008056 ADRA2C ADRA2L2; ADRA2RL2; ADRARL2; ALPHA2CAR adrenoceptor alpha 2C
TCMBANKGE009256 SLC6A2 NAT1; NET; NET1; SLC6A5 solute carrier family 6 member 2
TCMBANKGE012155 SLC6A3 DAT; DAT1; PKDYS; PKDYS1 solute carrier family 6 member 3
TCMBANKGE014790 ADRB1 ADRB1R; B1AR; BETA1AR; FNSS2; RHR adrenoceptor beta 1