CHEBI:140261 - adenosine-5'-(N-propyl)carboxamide

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ChEBI Name adenosine-5'-(N-propyl)carboxamide ChEBI ID CHEBI:140261 ChEBI ASCII Name adenosine-5'-(N-propyl)carboxamide Definition A monocarboxylic acid amide that is the propyl amide of adenosine 5'-carboxylic acid. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:705348, CHEBI:206536, CHEBI:277343 Supplier Information ZINC000087529283 Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C13H18N6O4 Net Charge 0 Average Mass 322.31980 Monoisotopic Mass 322.13895 InChI InChI=1S/C13H18N6O4/c1-2-3-15-12(22)9-7(20)8(21)13(23-9)19-5-18-6-10(14)16-4-17-11(6)19/h4-5,7-9,13,20-21H,2-3H2,1H3,(H,15,22)(H2,14,16,17)/t7-,8+,9-,13+/m0/s1 InChIKey UQGKLARJCHZHSS-QRIDJOKKSA-N SMILES CCCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 ChEBI Ontology Outgoing adenosine-5'-(N-propyl)carboxamide (CHEBI:140261) is a adenosines (CHEBI:22260) adenosine-5'-(N-propyl)carboxamide (CHEBI:140261) is a monocarboxylic acid amide (CHEBI:29347) IUPAC Name 1-(6-Amino-9H-purin-9-yl)-1-deoxy-N-propylribofuranuronamide Synonym Source (2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxy-N-propyltetrahydrofuran-2-carboxamide IUPAC Registry Number Type Source 57872-80-7 CAS Registry Number ChemIDplus Citations Types Sources 10212124 PubMed citation ChEMBL 11170630 PubMed citation ChEMBL 7365748 PubMed citation ChEMBL 7365748 PubMed citation ChEMBL Last Modified 05 March 2014