CHEBI:191288 - bio-5'-AMP

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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 bio-5'-AMP
ChEBI ID CHEBI:191288
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H28N7O9PS
Net Charge 0
Average Mass 573.520
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)
InChIKey UTQCSTJVMLODHM-UHFFFAOYSA-N
SMILES S1C(C2NC(=O)NC2C1)CCCCC(OP(OCC3OC(N4C5=NC=NC(N)=C5N=C4)C(O)C3O)(O)=O)=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in hTERT-RPE1 cell (BTO:0004790). See: MetaboLights Study
ChEBI Ontology
Outgoing bio-5'-AMP (CHEBI:191288) is a 5'-acylphosphoadenosine (CHEBI:16406)
IUPAC Name
[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] 5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoate
Manual Xref Database
570825 ChemSpider
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