9-[(2R,4R,5S)-5-(hydroxymethyl)-4-prop-1-en-2-yl-oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 9-[(2R,4R,5S)-5-(hydroxymethyl)-4-prop-1-en-2-yl-oxolan-2-yl]-3H-purin-6-one Openeye Name: 9-[(2R,4R,5S)-5-(hydroxymethyl)-4-isopropenyl-tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 9-[(2R,4R,5S)-5-(hydroxymethyl)-4-(1-methylethenyl)-2-oxolanyl]-3H-purin-6-one IUPAC Name: 9-[(2R,4R,5S)-5-(hydroxymethyl)-4-prop-1-en-2-yloxolan-2-yl]-3H-purin-6-one Traditional Name: 9-[(2R,4R,5S)-4-isopropenyl-5-methylol-tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C13H16N4O3 MolecularWeight: 276.29114

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1CC(OC1CO)N2C=NC3=C2NC=NC3=O

Isomeric SMILES

CC(=C)[C@H]1C[C@@H](O[C@@H]1CO)N2C=NC3=C2NC=NC3=O

InChI

InChI=1S/C13H16N4O3/c1-7(2)8-3-10(20-9(8)4-18)17-6-16-11-12(17)14-5-15-13(11)19/h5-6,8-10,18H,1,3-4H2,2H3,(H,14,15,19)/t8-,9-,10-/m1/s1