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CHEBI:71500 - cyclic di-AMP(2−)

ChEBI IDCHEBI:71500
ChEBI Namecyclic di-AMP(2−)
Stars
ASCII Namecyclic di-AMP(2-)
DefinitionAn organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of cyclic di-AMP; major species at pH 7.3.
Last Modified28 May 2019
SubmitterKAX
DownloadsMolfile
FormulaC20H22N10O12P2
Net Charge-2
Average Mass656.402
Monoisotopic Mass656.09049
SMILESNc1ncnc2c1ncn2[C@@H]1O[C@@H]2COP(=O)([O-])O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)([O-])O[C@H]2[C@H]1O
InChIInChI=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
InChIKeyPDXMFTWFFKBFIN-XPWFQUROSA-L
ChEBI Ontology
Outgoing Relation(s)
cyclic di-AMP(2−) (CHEBI:71500) is a organophosphate oxoanion (CHEBI:58945)
cyclic di-AMP(2−) (CHEBI:71500) is conjugate base of cyclic di-AMP (CHEBI:71578)
Incoming Relation(s)
cyclic di-AMP (CHEBI:71578) is conjugate acid of cyclic di-AMP(2−) (CHEBI:71500)
Synonyms  Source
cyclic di-3',5'-guanylate(2−)ChEBI
3',5'-cyclic di-AMP(2−)ChEBI
UniProt Name  Source
3',3'-c-di-AMPUniProt