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3',3'-c-di-AMP

Properties

Image

Occurences in reactions

MNX_ID

MNXM103353

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	2

formula

C₂₀H₂₂N₁₀O₁₂P₂

charge

-2

mass

656.09049

reference

chebi:71500

InChIKey

PDXMFTWFFKBFIN-XPWFQUROSA-L

InChI

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

SMILES

Nc1ncnc2c1ncn2[C@@H]1O[C@@H]2COP(=O)([O-])O[C@@H]3[C@@H](COP(=O)([O-])O[C@H]2[C@H]1O)O[C@@H](n1cnc2c(N)ncnc21)[C@@H]3O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:71500 chebi:71500	3',3'-c-di-AMP 3',5'-cyclic di-AMP(2-) cyclic di-3',5'-guanylate(2-) cyclic di-AMP(2-)
kegg.compound:C20565 keggC:C20565	Cyclic di-3',5'-adenylate Cyclic di-AMP
seed.compound:cpd31194 seedM:cpd31194	Cyclic di-3',5'-adenylate Cyclic di-AMP c-di-AMP cyclic di-3',5'-AMP cyclic di-3',5'-adenylate cyclic di-adenosine monophosphate cyclic diadenosine monophosphate
metacyc.compound:CPD-15225 metacycM:CPD-15225	cyclic di-3',5'-adenylate c-di-AMP cyclic di-3',5'-AMP cyclic di-adenosine monophosphate cyclic diadenosine monophosphate
CHEBI:71578 chebi:71578	cyclic di-AMP (2R,3R,3aS,7aR,9R,10R,10aS,14aR)-2,9-bis(6-amino-9H-purin-9-yl)octahydro-2H,7H-difuro[3,2-d:3',2'-j][1,3,7,9,2,8]tetraoxadiphosphacyclododecine-3,5,10,12-tetrol 5,12-dioxide 3',5'-cyclic di-AMP bis(3',5')-cyclic diadenylic acid bis-(3'-5')-cyclic dimeric adenosine monophosphate cyclic di-3',5'-adenylic acid
keggC:M_C20565 seedM:M_cpd31194	secondary/obsolete/fantasy identifier