2-azanyl-9-[(2R,3S,4S,5R)-5-ethenyl-5-(hydroxymethyl)-3-methyl-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[(2R,3S,4S,5R)-5-ethenyl-5-(hydroxymethyl)-3-methyl-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[(2R,3S,4S,5R)-4-hydroxy-5-(hydroxymethyl)-3-methyl-5-vinyl-tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-amino-9-[(2R,3S,4S,5R)-5-ethenyl-4-hydroxy-5-(hydroxymethyl)-3-methyl-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(2R,3S,4S,5R)-5-ethenyl-4-hydroxy-5-(hydroxymethyl)-3-methyloxolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[(2R,3S,4S,5R)-4-hydroxy-3-methyl-5-methylol-5-vinyl-tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C13H17N5O4 MolecularWeight: 307.30518

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)(CO)C=C)O

Isomeric SMILES

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

InChI

InChI=1S/C13H17N5O4/c1-3-13(4-19)8(20)6(2)11(22-13)18-5-15-7-9(18)16-12(14)17-10(7)21/h3,5-6,8,11,19-20H,1,4H2,2H3,(H3,14,16,17,21)/t6-,8-,11+,13+/m0/s1