Name: Xanthoplanine
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212672213
Cas No:6872-88-4
常用名:Xanthoplanine
IUPAC:(9S)-5-hydroxy-4,15,16-trimethoxy-10,10-dimethyl-10-azatetracyclo[7.7.1.0^{2,7}.0^{13,17}]heptadeca-1(17),2,4,6,13,15-hexaen-10-ium
IUPAC:(9S)-5-hydroxy-4,15,16-trimethoxy-10,10-dimethyl-10-azatetracyclo[7.7.1.0^{2,7}.0^{13,17}]heptadeca-1(17),2,4,6,13,15-hexaen-10-ium
InChI key:FGUCOPALAZXICJ-HNNXBMFYSA-O

分子式:C21H26NO4
分子量:356.441
氢键供体数 (HBD):1
氢键受体数 (HBA):4
LogP:-1.2375038
SMILES:[H][C@@]12Cc3cc(O)c(OC)cc3-c3c(OC)c(OC)cc(CC[N+]1(C)C)c23
SMILES:[H][C@@]12Cc3cc(O)c(OC)cc3-c3c(OC)c(OC)cc(CC[N+]1(C)C)c23

Xanthoplanine is a natural product isolated from theroot of Xylopia parviflora, and inhibits the EC50 ACh responses of both alpha7 and alpha4beta2 nACh receptors (IC50 of 9 μM and 5 μMc for alpha7 and alpha4beta2,respectively).

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