Name: Conodurine
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214315787
Cas No:2665-57-8
常用名:Conodurine
IUPAC:methyl 17-ethyl-5-[15-ethylidene-18-(methoxycarbonyl)-17-methyl-10,17-diazatetracyclo[12.3.1.0^{3,11}.0^{4,9}]octadeca-3(11),4,6,8-tetraen-12-yl]-6-methoxy-3,13-diazapentacyclo[13.3.1.0^{2,10}.0^{4,9}.0^{13,18}]nonadeca-2(10),4,6,8-tetraene-1-carboxylate
IUPAC:methyl 17-ethyl-5-[15-ethylidene-18-(methoxycarbonyl)-17-methyl-10,17-diazatetracyclo[12.3.1.0^{3,11}.0^{4,9}]octadeca-3(11),4,6,8-tetraen-12-yl]-6-methoxy-3,13-diazapentacyclo[13.3.1.0^{2,10}.0^{4,9}.0^{13,18}]nonadeca-2(10),4,6,8-tetraene-1-carboxylate
InChI key:QJHYXWBJZHUJGS-UHFFFAOYSA-N

分子式:C43H52N4O5
分子量:704.912
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CCC1CC2CN3CCc4c([nH]c5c(C6CC7C(C(Cc8c6[nH]c6ccccc86)N(C)CC7=CC)C(=O)OC)c(OC)ccc45)C(C2)(C13)C(=O)OC |w:33.37,THB:7:6:3.2:45.46,2:47:10.9.8.7:5.4.46|
SMILES:CCC1CC2CN3CCc4c([nH]c5c(C6CC7C(C(Cc8c6[nH]c6ccccc86)N(C)CC7=CC)C(=O)OC)c(OC)ccc45)C(C2)(C13)C(=O)OC |w:33.37,THB:7:6:3.2:45.46,2:47:10.9.8.7:5.4.46|

Conodurine shows leishmanicidal and antibacterial activities, it shows inhibition activity for acetyl (AChE) and butyrylcholinesterase (BuChE).

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