Name: E7766 diammonium salt
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT218964015
Cas No:2242635-03-4
常用名:E7766 diammonium salt
IUPAC:(1R,3R,15Z,28R,29R,30R,31R,36R,41R)-29,41-difluoro-34,39-disulfanyl-2,33,35,38,40,42-hexaoxa-4,6,9,11,13,18,20,22,25,27-decaaza-34lambda5,39lambda5-diphosphaoctacyclo[28.6.4.1^{3,36}.1^{28,31}.0^{4,8}.0^{7,12}.0^{19,24}.0^{23,27}]dotetraconta-5,7,10,12,15,19(24),20,22,25-nonaene-34,39-dione amine
IUPAC:(1R,3R,15Z,28R,29R,30R,31R,36R,41R)-29,41-difluoro-34,39-disulfanyl-2,33,35,38,40,42-hexaoxa-4,6,9,11,13,18,20,22,25,27-decaaza-34lambda5,39lambda5-diphosphaoctacyclo[28.6.4.1^{3,36}.1^{28,31}.0^{4,8}.0^{7,12}.0^{19,24}.0^{23,27}]dotetraconta-5,7,10,12,15,19(24),20,22,25-nonaene-34,39-dione amine
InChI key:JVSUYRKSTBVELL-FHWFAZEDSA-N

分子式:C24H29F2N11O8P2S2
分子量:763.63
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:N.[H][C@@]12COP(S)(=O)O[C@@]3([H])[C@@H](F)[C@@]4([H])O[C@]3([H])COP(S)(=O)O[C@@]1([H])[C@@H](F)[C@@]([H])(O2)n1cnc2c1NC=NC2=NC\C=C/CNc1ncnc2n4cnc12
SMILES:N.[H][C@@]12COP(S)(=O)O[C@@]3([H])[C@@H](F)[C@@]4([H])O[C@]3([H])COP(S)(=O)O[C@@]1([H])[C@@H](F)[C@@]([H])(O2)n1cnc2c1NC=NC2=NC\C=C/CNc1ncnc2n4cnc12

E7766 diammonium salt 是一种大环桥连STING 激动剂，Kd 为 40 nM。E7766 diammonium salt 显示出强大的泛基因型和抗肿瘤活性。

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