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

Systemtic Name: 2-azanyl-9-[(2S,3S,4S,5R)-5-azido-5-(hydroxymethyl)-3-methyl-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[(2S,3S,4S,5R)-5-azido-4-hydroxy-5-(hydroxymethyl)-3-methyl-tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-amino-9-[(2S,3S,4S,5R)-5-azido-4-hydroxy-5-(hydroxymethyl)-3-methyl-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(2S,3S,4S,5R)-5-azido-4-hydroxy-5-(hydroxymethyl)-3-methyloxolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[(2S,3S,4S,5R)-5-azido-4-hydroxy-3-methyl-5-methylol-tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C11H14N8O4 MolecularWeight: 322.28006

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)(CO)N=[N+]=[N-])O

Isomeric SMILES

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

InChI

InChI=1S/C11H14N8O4/c1-4-6(21)11(2-20,17-18-13)23-9(4)19-3-14-5-7(19)15-10(12)16-8(5)22/h3-4,6,9,20-21H,2H2,1H3,(H3,12,15,16,22)/t4-,6-,9-,11+/m0/s1