CHEBI:142458 - 5'-hydroxy-diadenylate with a cyclic 2',3' phosphate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 5'-hydroxy-diadenylate with a cyclic 2',3' phosphate
ChEBI ID CHEBI:142458
Definition A linear 5'-hydroxy-diadenylate with a cyclic 2',3' phosphate terminus; major species at pH 7.3.
Stars This entity has been manually annotated by a third party.
Submitter Anne Morgat
Supplier Information
Download Molfile XML SDF
Formula C20H22N10O12P2
Net Charge -2
Average Mass 656.397
Monoisotopic Mass 656.09049
InChI InChI=1S/C20H24N10O12P2/c21-15-9-17(25-3-23-15)29(5-27-9)19-11(32)12(7(1-31)38-19)40-43(33,34)37-2-8-13-14(42-44(35,36)41-13)20(39-8)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 ZKDCIJKZCQKMKS-XPWFQUROSA-L
SMILES NC1=NC=NC2=C1N=CN2[C@@H]3O[C@H](CO)[C@@H](OP(OC[C@H]4O[C@@H](N5C=6N=CN=C(N)C6N=C5)[C@H]7[C@@H]4OP([O-])(=O)O7)(=O)[O-])[C@H]3O
ChEBI Ontology
Outgoing 5'-hydroxy-diadenylate with a cyclic 2',3' phosphate (CHEBI:142458) is a adenyl ribonucleotide (CHEBI:61296)
5'-hydroxy-diadenylate with a cyclic 2',3' phosphate (CHEBI:142458) is a cyclic oligonucleotide (CHEBI:75878)
5'-hydroxy-diadenylate with a cyclic 2',3' phosphate (CHEBI:142458) is a organophosphate oxoanion (CHEBI:58945)
Synonym Source
5'-hydroxy-diadenylate 2',3'-cylic phosphate UniProt
Citation Waiting for Citations Type Source
30232454 PubMed citation SUBMITTER