Compound Summary


  Compound Information

药名:

Eseramine

别名:

UNII-PE4VD738WT; AC1MJ1L1; N-methylcarbamic acid [(3aS,8bS)-4,8b-dimethyl-3-(methylcarbamoyl)-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl] ester; BDBM50022773; [(3aS,8bS)-4,8b-dimethyl-3-(methylcarbamoyl)-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl] N-methylcarbamate; 6091-57-2; (3aS-cis)-3,3a,8,8a-Tetrahydro-N,3a,8-trimethyl-5-[[(methylamino)carbonyl]oxy]-pyrrolo[2,3-b]indole-1(2H)-carboxamide; C09170; CHEMBL77799; eseramine; PE4VD738WT; Pyrrolo(2,3-b)indole-1(2H)-carboxamide, 3,3a,8,8a-tetrahydro-N,3a,8-trimethyl-5-(((methylamino)carbonyl)oxy)-, (3aS-cis)-; Methyl-carbamic acid 3a,8-dimethyl-1-methylcarbamoyl-1,2,3,3a,8,8a-hexahydro-pyrrolo[2,3-b]indol-5-yl ester; [(8bS)-4,8b-dimethyl-3-(methylcarbamoyl)-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl] N-methylcarbamate

分子式:

C16H22N4O3

Smiles:

CC12CCN(C1N(C3=C2C=C(C=C3)OC(=O)NC)C)C(=O)NC

成分:

HBIN025804

OB_score:

45.887035

CAS_id:

6091-57-2

SymMap_id:

SMIT07010;SMIT15318

TCMID_id:

7378

TCMSP_id:

MOL005220

PubChem_id:

3083935


   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
TCMBANKHE000231 Sedum ewersii
TCMBANKHE002206 罗布麻叶
TCMBANKHE003225 Fraxinus rhynchophylla [Syn. Fraxinus chinensis var. rhynchophylla] To clearheat and dry damp, promote astriction, brighten eyes./Heat dysentery, diarrhea, chronic bronchitis, rheumatic arthritis, red and white vaginal discharge, red eyes with gall, eye screen.
TCMBANKHE003816 Periploca graeca 希腊杠柳
TCMBANKHE003863 Herba Cichorii 菊苣 To remove heat from the liver, to stimulate the discharge of bile, to promote digestion and increase appetite, and to cause diuresis./Treatment of jaundice caused by damp-heat, epigastric pain with impairment of appetite, edema with oliguria.
TCMBANKHE004108 Physostigma venenosum 毒扁豆
TCMBANKHE004113 Fraxinus ornus 花白蜡树
TCMBANKHE006321 Anisodus tanguticus [Syn. Scopolia tangutica ] 藏茄 To anesthetize and settle pain, resolve tetany and disperse swelling./Shock, shock due to acute infectious diseases, cerebral thrombosis, acute spinal cord inflammation, spasm of biliary ducts or duodenum, acute gastroenteritis, chronic gastroenteritis, contracturepain in stomach duct and abdomen, ascaridosis in biliary tract, gallstones, swelling toxin of welling abscess and flat abscess, knocks and falls, fracture.
TCMBANKHE004578 Melilotus suaveolens 辟汗草 To clear summerheat and transform damp, fortify stomach and harmonize center./Summerheat-damp and oppression in chest, distended head and headache, dysentery, malaria, strangury syndrome, vaginal discharge, mouth sore, bad breath, sores, damp sore, scab and lichen, scrofula.
TCMBANKHE005729 Semen Euphorbiae 千金子 To cause drastic purgation for treating edema, and eliminate blood stasis for treating masses./Edema, phlegm-rheum, accumulation and distention-fullness, urinary and fecal stoppage, amenorrhea due to blood stasis, intractable impediment, wart.
TCMBANKHE006867 Solanum xanthocarpum 黄果茄 To clear heat and disinhibit damp, disperse stasis and relieve pain./Wind-damp impediment pain, toothache, painful swollen testes, welling abscess and boil.
TCMBANKHE007168 Koelpinia linearis 蝎尾菊
TCMBANKHE007419 Aesculus turbinata 日本七叶树
TCMBANKHE007933 Citrus limonia 黎檬 See Citrus limon./See Citrus limon .
TCMBANKHE009046/XU-492 Bidens tripartita 狼杷草 广西省来宾市金秀县 To clear heat and resolve toxin, disinhibit damp, free menstruation./Lung heat cough, hemoptysis, swelling pain in throat, red and white dysentery, jaundice, menstrual disorder, amenorrhea, child gan accumulation, scrofula, eczema, lichen sore, poisonous snake bite.
TCMBANKHE008906 Erica vagans 英国欧石楠
TCMBANKHE009120/XU-579 Cichorium intybus 菊苣 四川省甘孜州泸定县 To clear heat and resolve exterior, disinhibit urine and disperse edema./Damp-heat jaundice, nephritis with edema, distending pain in stomach duct, inappetence.

   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
TCMBANKGE000633 ADRB2 ADRB2R; ADRBR; B2AR; BAR; BETA2AR adrenoceptor beta 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
TCMBANKGE000938 CDK2 CDKN2; p33(CDK2) cyclin dependent kinase 2
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
TCMBANKGE008702 OPRM1 LMOR; M-OR-1; MOP; MOR; MOR1; OPRM opioid receptor mu 1
TCMBANKGE011079 PRSS1 TRP1; TRY1; TRY4; TRYP1 serine protease 1