Name: (1R,3R,6R,8R,9R,10S,12S,17R,18R)-8,17-bis(6-aminopurin-9-yl)-9,18-dihydroxy-3,12-disulfanyl-2,4,7,11,13,16-hexaoxa-3lambda5,12lambda5-diphosphatricyclo[13.2.1.0^{6,10}]octadecane-3,12-dione
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sdf 文件

结构编辑

类似物检索

HIT ID:HIT219591977
Cas No:1638241-89-0
常用名:(1R,3R,6R,8R,9R,10S,12S,17R,18R)-8,17-bis(6-aminopurin-9-yl)-9,18-dihydroxy-3,12-disulfanyl-2,4,7,11,13,16-hexaoxa-3lambda5,12lambda5-diphosphatricyclo[13.2.1.0^{6,10}]octadecane-3,12-dione
常用名:(1R,3R,6R,8R,9R,10S,12S,17R,18R)-8,17-bis(6-aminopurin-9-yl)-9,18-dihydroxy-3,12-disulfanyl-2,4,7,11,13,16-hexaoxa-3lambda5,12lambda5-diphosphatricyclo[13.2.1.0^{6,10}]octadecane-3,12-dione
IUPAC:(1R,3R,6R,8R,9R,10S,12S,17R,18R)-8,17-bis(6-amino-9H-purin-9-yl)-9,18-dihydroxy-3,12-disulfanyl-2,4,7,11,13,16-hexaoxa-3lambda5,12lambda5-diphosphatricyclo[13.2.1.0^{6,10}]octadecane-3,12-dione
IUPAC:(1R,3R,6R,8R,9R,10S,12S,17R,18R)-8,17-bis(6-amino-9H-purin-9-yl)-9,18-dihydroxy-3,12-disulfanyl-2,4,7,11,13,16-hexaoxa-3lambda5,12lambda5-diphosphatricyclo[13.2.1.0^{6,10}]octadecane-3,12-dione
InChI key:IZJJFUQKKZFVLH-IYLPVLLISA-N

分子式:C20H24N10O10P2S2
分子量:690.54
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H]C12CO[P@@](S)(=O)O[C@@]3([H])[C@@H](O)[C@@H](O[C@]3([H])CO[P@](S)(=O)O[C@]([H])([C@@H]1O)[C@@H](O2)n1cnc2c(N)ncnc12)n1cnc2c(N)ncnc12
SMILES:[H]C12CO[P@@](S)(=O)O[C@@]3([H])[C@@H](O)[C@@H](O[C@]3([H])CO[P@](S)(=O)O[C@]([H])([C@@H]1O)[C@@H](O2)n1cnc2c(N)ncnc12)n1cnc2c(N)ncnc12

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