CHEBI:17709 - 5'-adenylyl sulfate

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ChEBI Name 5'-adenylyl sulfate
ChEBI ID CHEBI:17709
Definition An adenosine 5'-phosphate having a sulfo group attached to one the phosphate OH groups.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:40562, CHEBI:12059, CHEBI:2486, CHEBI:13741, CHEBI:13743, CHEBI:22247
Supplier Information
Download Molfile XML SDF
Formula C10H14N5O10PS
Net Charge 0
Average Mass 427.28562
Monoisotopic Mass 427.020
InChI InChI=1S/C10H14N5O10PS/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-26(18,19)25-27(20,21)22/h2-4,6-7,10,16-17H,1H2,(H,18,19)(H2,11,12,13)(H,20,21,22)/t4-,6-,7-,10-/m1/s1
InChIKey IRLPACMLTUPBCL-KQYNXXCUSA-N
SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)OS(O)(=O)=O)[C@@H](O)[C@H]1O
Metabolite of Species Details
Mus musculus (NCBI:10090) Source: BioModels - MODEL1507180067 See: PubMed
Escherichia coli (NCBI:562) See: PubMed
Roles Classification
Biological Role(s): Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 5'-adenylyl sulfate (CHEBI:17709) has role Escherichia coli metabolite (CHEBI:76971)
5'-adenylyl sulfate (CHEBI:17709) has role mouse metabolite (CHEBI:75771)
5'-adenylyl sulfate (CHEBI:17709) is a acyl monophosphate (CHEBI:16826)
5'-adenylyl sulfate (CHEBI:17709) is a acyl sulfate (CHEBI:37875)
5'-adenylyl sulfate (CHEBI:17709) is a adenosine 5'-phosphate (CHEBI:37096)
5'-adenylyl sulfate (CHEBI:17709) is conjugate acid of 5'-adenylyl sulfate(2−) (CHEBI:58243)
Incoming 2'-phospho-5'-adenylyl sulfate (CHEBI:848) has functional parent 5'-adenylyl sulfate (CHEBI:17709)
3'-phospho-5'-adenylyl sulfate (CHEBI:17980) has functional parent 5'-adenylyl sulfate (CHEBI:17709)
5'-adenylyl sulfate(2−) (CHEBI:58243) is conjugate base of 5'-adenylyl sulfate (CHEBI:17709)
IUPAC Name
5'-adenylyl hydrogen sulfate
Synonyms Sources
5'-Adenylyl sulfate KEGG COMPOUND
Adenosine 5'-phosphosulfate KEGG COMPOUND
adenosine phosphosulfate ChemIDplus
ADENOSINE-5'-PHOSPHOSULFATE PDBeChem
Adenylylsulfate KEGG COMPOUND
APS KEGG COMPOUND
Database Links Databases
ADX PDBeChem
C00007445 KNApSAcK
C00224 KEGG COMPOUND
DB03708 DrugBank
View more database links
Registry Number Type Source
485-84-7 CAS Registry Number ChemIDplus
Last Modified
27 January 2016