Compound Summary


  Compound Information

药名:

Diethylacetic acid

别名:

NSC 11765; EINECS 201-796-4; AI3-04629; InChI=1/C6H12O2/c1-3-5(4-2)6(7)8/h5H,3-4H2,1-2H3,(H,7,8; Acetic acid, diethyl-; 2-Ethylbutanoic acid; LMFA01020077; 3-Pentanecarboxylic acid; diethyl acetic acid; BRN 1098634; 88-09-5; NSC11765; 2-ethyl-butanoic acid; FEMA No. 2429; 2-Ethyl butanoic acid; NSC8758; Butyric acid, 2-ethyl-; alpha-Ethylbuytyric acid; 03190_FLUKA; .alpha.-Ethylbutyric acid; 4-02-00-00950 (Beilstein Handbook Reference); WLN: QVY2&2; Butanoic acid, 2-ethyl-; 2-Ethylbutyric acid; alpha-Ethylbutyric acid; 109959_ALDRICH; 134331-89-8; W242918_ALDRICH; Kyselina diethyloctova [Czech]

分子式:

C6H12O2

Smiles:

CCC(CC)C(=O)O

成分:

HBIN023751

OB_score:

54.859267

CAS_id:

1988-09-05

SymMap_id:

SMIT10914

TCMSP_id:

MOL009831

PubChem_id:

6915


   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
TCMBANKHE006021 Semen Sesami Nigrum 黑芝麻 To tonify the liver and the kidney, to replenish vital essence and blood, and to relax the bowels./Dizziness, tinnitus and deafness, premature graying in beard and hair, hair loss during convalescence, intestinal dry and constipation.
TCMBANKHE006919 flos farfarae 款冬花 To relieve cough and resolve phlegm to nourish the lung to keep the adverse qi downward./Cough, cough and asthma with abundant phlegm, consumption cough and hemoptysis, chronic bronchitis, infection of upper respiratory tract, tuberculosis.

   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
TCMBANKGE000469 CTSD CLN10; CPSD; HEL-S-130P cathepsin D
TCMBANKGE000766 ACHE ACEE; ARACHE; N-ACHE; YT acetylcholinesterase (Cartwright blood group)
TCMBANKGE000813 DPP4 ADABP; ADCP2; CD26; DPPIV; TP103 dipeptidyl peptidase 4
TCMBANKGE000903 PTGS1 COX1; COX3; PCOX1; PES-1; PGG/HS; PGHS-1; PGHS1; PHS1; PTGHS prostaglandin-endoperoxide synthase 1
TCMBANKGE000994 AKR1B1 ADR; ALDR1; ALR2; AR aldo-keto reductase family 1 member B
TCMBANKGE001890 ME2 ODS1 malic enzyme 2
TCMBANKGE003342 GATM AGAT; AT; CCDS3 glycine amidinotransferase
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
TCMBANKGE014656 ABAT GABA-AT; GABAT; NPD009 4-aminobutyrate aminotransferase