2-(6-aminopurin-9-yl)-5-[[[(E)-5-azanylpent-3-enyl]amino]methyl]oxolane-3,4-diol

Systemtic Name: 2-(6-aminopurin-9-yl)-5-[[[(E)-5-azanylpent-3-enyl]amino]methyl]oxolane-3,4-diol Openeye Name: 2-[[[(E)-5-aminopent-3-enyl]amino]methyl]-5-(6-aminopurin-9-yl)tetrahydrofuran-3,4-diol CAS Name: 2-[[[(E)-5-aminopent-3-enyl]amino]methyl]-5-(6-aminopurin-9-yl)oxolane-3,4-diol IUPAC Name: 2-[[[(E)-5-aminopent-3-enyl]amino]methyl]-5-(6-aminopurin-9-yl)oxolane-3,4-diol Traditional Name: 2-adenin-9-yl-5-[[[(E)-5-aminopent-3-enyl]amino]methyl]tetrahydrofuran-3,4-diol Formula: C15H23N7O3 MolecularWeight: 349.38822

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CNCCC=CCN)O)O

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CNCC/C=C/CN)O)O

InChI

InChI=1S/C15H23N7O3/c16-4-2-1-3-5-18-6-9-11(23)12(24)15(25-9)22-8-21-10-13(17)19-7-20-14(10)22/h1-2,7-9,11-12,15,18,23-24H,3-6,16H2,(H2,17,19,20)/b2-1+