6-[6-azanyl-9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-3H-purin-6-yl]hexanal

Systemtic Name: 6-[6-azanyl-9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-3H-purin-6-yl]hexanal Openeye Name: 6-[6-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3H-purin-6-yl]hexanal CAS Name: 6-[6-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-3H-purin-6-yl]hexanal IUPAC Name: 6-[6-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-yl]hexanal Traditional Name: 6-[6-amino-9-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)-3H-purin-6-yl]hexanal Formula: C16H25N5O5 MolecularWeight: 367.4002

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(C2=C(N1)N(C=N2)C3C(C(C(O3)CO)O)O)(CCCCCC=O)N

Isomeric SMILES

C1=NC(C2=C(N1)N(C=N2)C3C(C(C(O3)CO)O)O)(CCCCCC=O)N

InChI

InChI=1S/C16H25N5O5/c17-16(5-3-1-2-4-6-22)13-14(18-8-20-16)21(9-19-13)15-12(25)11(24)10(7-23)26-15/h6,8-12,15,23-25H,1-5,7,17H2,(H,18,20)