(3aR,4R,6R,6aR)-4-[2,4-bis(azanyl)pyrrolo[2,3-d]pyrimidin-7-yl]-6-(hydroxymethyl)-3a-methyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-2-one

Systemtic Name: (3aR,4R,6R,6aR)-4-[2,4-bis(azanyl)pyrrolo[2,3-d]pyrimidin-7-yl]-6-(hydroxymethyl)-3a-methyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-2-one Openeye Name: (3aR,4R,6R,6aR)-4-(2,4-diaminopyrrolo[2,3-d]pyrimidin-7-yl)-6-(hydroxymethyl)-3a-methyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-2-one CAS Name: (3aR,4R,6R,6aR)-4-(2,4-diamino-7-pyrrolo[2,3-d]pyrimidinyl)-6-(hydroxymethyl)-3a-methyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-2-one IUPAC Name: (3aR,4R,6R,6aR)-4-(2,4-diaminopyrrolo[2,3-d]pyrimidin-7-yl)-6-(hydroxymethyl)-3a-methyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-2-one Traditional Name: (3aR,4R,6R,6aR)-4-(2,4-diaminopyrrolo[2,3-d]pyrimidin-7-yl)-3a-methyl-6-methylol-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-2-one Formula: C13H15N5O5 MolecularWeight: 321.2887

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Descriptors Computed from Structure

Canonical SMILES:

CC12C(C(OC1N3C=CC4=C3N=C(N=C4N)N)CO)OC(=O)O2

Isomeric SMILES

C[C@@]12[C@@H]([C@H](O[C@H]1N3C=CC4=C3N=C(N=C4N)N)CO)OC(=O)O2

InChI

InChI=1S/C13H15N5O5/c1-13-7(22-12(20)23-13)6(4-19)21-10(13)18-3-2-5-8(14)16-11(15)17-9(5)18/h2-3,6-7,10,19H,4H2,1H3,(H4,14,15,16,17)/t6-,7-,10-,13-/m1/s1