CHEBI:3110 - biotinyl-5'-AMP

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name biotinyl-5'-AMP
ChEBI ID CHEBI:3110
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C20H28N7O9PS
Net Charge 0
Average Mass 573.51786
Monoisotopic Mass 573.14068
InChI InChI=1S/C20H28N7O9PS/c21-17-14-18(23-7-22-17)27(8-24-14)19-16(30)15(29)10(35-19)5-34-37(32,33)36-12(28)4-2-1-3-11-13-9(6-38-11)25-20(31)26-13/h7-11,13,15-16,19,29-30H,1-6H2,(H,32,33)(H2,21,22,23)(H2,25,26,31)/t9-,10+,11-,13-,15+,16+,19+/m0/s1
InChIKey UTQCSTJVMLODHM-RHCAYAJFSA-N
SMILES [H][C@]12CS[C@@H](CCCCC(=O)OP(O)(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)[C@@]1([H])NC(=O)N2
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing biotinyl-5'-AMP (CHEBI:3110) has functional parent adenosine 5'-monophosphate (CHEBI:16027)
biotinyl-5'-AMP (CHEBI:3110) has functional parent biotin (CHEBI:15956)
biotinyl-5'-AMP (CHEBI:3110) has role human metabolite (CHEBI:77746)
biotinyl-5'-AMP (CHEBI:3110) has role mouse metabolite (CHEBI:75771)
biotinyl-5'-AMP (CHEBI:3110) is a purine ribonucleoside 5'-monophosphate (CHEBI:37021)
biotinyl-5'-AMP (CHEBI:3110) is conjugate acid of biotinyl-5'-AMP(1−) (CHEBI:62414)
Incoming biotinyl-5'-AMP(1−) (CHEBI:62414) is conjugate base of biotinyl-5'-AMP (CHEBI:3110)
IUPAC Name
5'-O-[hydroxy({5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoyl}oxy)phosphoryl]adenosine
Synonym Source
Biotinyl-5'-AMP KEGG COMPOUND
Manual Xref Database
C05921 KEGG COMPOUND
View more database links
Registry Number Type Source
20733000 Reaxys Registry Number Reaxys
Last Modified
07 March 2016