Chem
J-GLOBAL ID：201407063266372495   Nikkaji number：J3.235.540D

2′-O,5′-O-[(Guanosine-2′-O,5′-O-diyl)bisphosphinico]adenosine

2′-O,5′-O-[(グアノシン-2′-O,5′-O-ジイル)ビスホスフィニコ]アデノシン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C20H24N10O13P2
Molecular formula furigana： C20-H24-N10-O13-P2
Molecular weight： 674.417
InChI： InChI=1S/C20H24N10O13P2/c21-14-8-15(24-3-23-14)29(4-25-8)18-12-10(31)6(40-18)1-38-45(36,37)43-13-11(32)7(2-39-44(34,35)42-12)41-19(13)30-5-26-9-16(30)27-20(22)28-17(9)33/h3-7,10-13,18-19,31-32H,1-2H2,(H,34,35)(H,36,37)(H2,21,23,24)(H3,22,27,28,33)/t6-,7-,10-,11-,12-,13-,18-,19-/m1/s1
InChI key： BQZWXNITEWDGCM-INFSMZHSSA-N
SMILES： Nc1nc2n(cnc2c(=O)[nH]1)[C@@H]1O[C@@H]2COP(=O)(O)O[C@@H]3[C@H](O)[C@@H](COP(=O)(O)O[C@@H]1[C@@H]2O)O[C@H]3n1cnc2c(N)ncnc12
Systematic name  (3)：
  • 2′-O,5′-O-[(グアノシン-2′-O,5′-O-ジイル)ビスホスフィニコ]アデノシン
  • (1R,6R,8R,9R,14R,16R,17R,18R)-8-(2-アミノ-6-オキソ-6,9-ジヒドロ-1H-プリン-9-イル)-16-(6-アミノ-9H-プリン-9-イル)-3,11,17,18-テトラヒドロキシ-2,4,7,10,12,15-ヘキサオキサ-3λ5,11λ5-ジホスファトリシクロ[12.2.1.16,9]オクタデカン-3,11-ジオン
  • (1R,6R,8R,9R,14R,16R,17R,18R)-8-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)-16-(6-amino-9H-purin-9-yl)-3,11,17,18-tetrahydroxy-2,4,7,10,12,15-hexaoxa-3λ5,11λ5-diphosphatricyclo[12.2.1.16,9]octadecane-3,11-dione
Other name (1)：
  • 2′-O,5′-O-[(Guanosine-2′-O,5′-O-diyl)bisphosphinico]adenosine
Thsaurus map：
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