2-azanyl-9-[[(2S)-2-azido-2-phosphonato-oxolan-3-yl]methyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[[(2S)-2-azido-2-phosphonato-oxolan-3-yl]methyl]-3H-purin-6-one Openeye Name: 2-amino-9-[[(2S)-2-azido-2-phosphonato-tetrahydrofuran-3-yl]methyl]-3H-purin-6-one CAS Name: 2-amino-9-[[(2S)-2-azido-2-phosphonato-3-oxolanyl]methyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[[(2S)-2-azido-2-phosphonatooxolan-3-yl]methyl]-3H-purin-6-one Traditional Name: 2-amino-9-[[(2S)-2-azido-2-phosphonato-tetrahydrofuran-3-yl]methyl]-3H-purin-6-one Formula: C10H11N8O5P-2 MolecularWeight: 354.218701

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C1CN2C=NC3=C2NC(=NC3=O)N)(N=[N+]=[N-])P(=O)([O-])[O-]

Isomeric SMILES

C1CO[C@](C1CN2C=NC3=C2NC(=NC3=O)N)(N=[N+]=[N-])P(=O)([O-])[O-]

InChI

InChI=1S/C10H13N8O5P/c11-9-14-7-6(8(19)15-9)13-4-18(7)3-5-1-2-23-10(5,16-17-12)24(20,21)22/h4-5H,1-3H2,(H2,20,21,22)(H3,11,14,15,19)/p-2/t5?,10-/m0/s1