2-(6-aminopurin-9-yl)-3-oxidanyl-2-(1-oxidanyl-3-oxidanylidene-propan-2-yl)oxy-propanal

Systemtic Name: 2-(6-aminopurin-9-yl)-3-oxidanyl-2-(1-oxidanyl-3-oxidanylidene-propan-2-yl)oxy-propanal Openeye Name: 2-(6-aminopurin-9-yl)-2-(1-formyl-2-hydroxy-ethoxy)-3-hydroxy-propanal CAS Name: 2-(6-aminopurin-9-yl)-3-hydroxy-2-(1-hydroxy-3-oxopropan-2-yl)oxypropanal IUPAC Name: 2-(6-aminopurin-9-yl)-3-hydroxy-2-(1-hydroxy-3-oxopropan-2-yl)oxypropanal Traditional Name: 2-adenin-9-yl-2-(1-formyl-2-hydroxy-ethoxy)-3-hydroxy-propionaldehyde Formula: C11H13N5O5 MolecularWeight: 295.25142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N5O5/c12-9-8-10(14-5-13-9)16(6-15-8)11(3-19,4-20)21-7(1-17)2-18/h1,3,5-7,18,20H,2,4H2,(H2,12,13,14)