cyclic di-3',5'-adenylate

Chemical Formula:

C₂₀H₂₂N₁₀O₁₂P₂

Molecular Weight:

656.401 Daltons

Monoisotopic Mass:

658.1050393075999 Daltons

SMILES:

C1(C7(C(OP([O-])(=O)OCC4(C(OP([O-])(=O)O1)C(O)C(N3(C2(N=CN=C(N)C=2N=C3)))O4))C(O)C(N6(C5(N=CN=C(N)C=5N=C6)))O7))

InChI:

1S/C20H24N10O12P2/c21-15-9-17(25-3-23-15)29(5-27-9)19-11(31)13-7(39-19)1-37-43(33,34)42-14-8(2-38-44(35,36)41-13)40-20(12(14)32)30-6-28-10-16(22)24-4-26-18(10)30/h3-8,11-14,19-20,31-32H,1-2H2,(H,33,34)(H,35,36)(H2,21,23,25)(H2,22,24,26)/p-2/t7-,8-,11-,12-,13-,14-,19-,20-/m1/s1

InChIKey:

PDXMFTWFFKBFIN-XPWFQUROSA-L

Synonyms

cyclic di-3',5'-AMP
cyclic di-adenosine monophosphate
cyclic diadenosine monophosphate

Databases

MetaCyc: CPD-15225

PubChem (CID): 70698365

ChEBI: 71500

MetaNetX: MNXM103353

KEGG: C20565