5'-Adenylic acid, N-(4-aminobutyl)-

Base Information

Chemical Name:5'-Adenylic acid, N-(4-aminobutyl)-
CAS No.:78261-65-1
Molecular Formula:C₁₄H₂₃N₆O₇P
Molecular Weight:418.346
Hs Code.:
DSSTox Substance ID:DTXSID60460383
Wikidata:Q82284414

Synonyms:78261-65-1;((2R,3S,4R,5R)-5-(6-((4-Aminobutyl)amino)-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl dihydrogen phosphate;5'-Adenylic acid, N-(4-aminobutyl)-;SCHEMBL4820076;DTXSID60460383;{[(2R,3S,4R,5R)-5-{6-[(4-aminobutyl)amino]-9H-purin-9-yl}-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid

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Chemical Property of 5'-Adenylic acid, N-(4-aminobutyl)-

Chemical Property:

XLogP3:-5.4
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:9
Exact Mass:418.13658409
Heavy Atom Count:28
Complexity:556

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MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O)NCCCCN
Isomeric SMILES:C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)NCCCCN

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Technology Process of 5'-Adenylic acid, N-(4-aminobutyl)-

5'-Adenylic acid, N-(4-aminobutyl)-

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