2-[(6-aminopurin-9-yl)methylidene]propane-1,3-diol

Systemtic Name: 2-[(6-aminopurin-9-yl)methylidene]propane-1,3-diol Openeye Name: 2-[(6-aminopurin-9-yl)methylene]propane-1,3-diol CAS Name: 2-[(6-aminopurin-9-yl)methylidene]propane-1,3-diol IUPAC Name: 2-[(6-aminopurin-9-yl)methylidene]propane-1,3-diol Traditional Name: 2-(adenin-9-ylmethylene)propane-1,3-diol Formula: C9H11N5O2 MolecularWeight: 221.21594

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2C=C(CO)CO

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2C=C(CO)CO

InChI

InChI=1S/C9H11N5O2/c10-8-7-9(12-4-11-8)14(5-13-7)1-6(2-15)3-16/h1,4-5,15-16H,2-3H2,(H2,10,11,12)