P1,P2-Bis(5'-adenosyl) triphosphate

Molecular Formula: C₂₀H₂₇N₁₀O₁₆P₃

InChI: InChI=1/C20H27N10O16P3/c21-15-9-17(25-3-23-15)29(5-27-9)19-13(33)11(31)7(43-19)1-41-48(38,39)46-49(40,45-47(35,36)37)42-2-8-12(32)14(34)20(44-8)30-6-28-10-16(22)24-4-26-18(10)30/h3-8,11-14,19-20,31-34H,1-2H2,(H,38,39)(H2,21,23,25)(H2,22,24,26)(H2,35,36,37)/t7-,8-,11-,12-,13-,14-,19-,20-,49u/m1/s1/f/h35-36,38H,21-22H2

InChIKey: InChIKey=ARWCWVFBZSAGRB-NYPRQQFTDI
SMILES: C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)COP(=O)(O)OP(=O)(OCC4C(C(C(O4)N5C=NC6=C5N=CN=C6N)O)O)OP(=O)(O)O)O)O

Names:
    C04307
    P1,P2-Bis(5'-adenosyl) triphosphate
    [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-phosphoryl]oxyphosphonic acid

Registries:
    PubChem CID 440292
    PubChem ID 6965