2-[9-[(4aR,6R,7R,7aR)-7-methoxy-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-6-azanyl-purin-8-yl]sulfanylethanol

Systemtic Name: 2-[9-[(4aR,6R,7R,7aR)-7-methoxy-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-6-azanyl-purin-8-yl]sulfanylethanol Openeye Name: 2-[9-[(4aR,6R,7R,7aR)-2-hydroxy-7-methoxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-6-amino-purin-8-yl]sulfanylethanol CAS Name: 2-[[9-[(4aR,6R,7R,7aR)-2-hydroxy-7-methoxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-6-amino-8-purinyl]thio]ethanol IUPAC Name: 2-[9-[(4aR,6R,7R,7aR)-2-hydroxy-7-methoxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-6-aminopurin-8-yl]sulfanylethanol Traditional Name: 2-[[9-[(4aR,6R,7R,7aR)-2-hydroxy-2-keto-7-methoxy-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-6-amino-purin-8-yl]thio]ethanol Formula: C13H18N5O7PS MolecularWeight: 419.350081

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Descriptors Computed from Structure

Canonical SMILES:

COC1C2C(COP(=O)(O2)O)OC1N3C4=C(C(=NC=N4)N)N=C3SCCO

Isomeric SMILES

CO[C@@H]1[C@H]2[C@@H](COP(=O)(O2)O)O[C@H]1N3C4=C(C(=NC=N4)N)N=C3SCCO

InChI

InChI=1S/C13H18N5O7PS/c1-22-9-8-6(4-23-26(20,21)25-8)24-12(9)18-11-7(10(14)15-5-16-11)17-13(18)27-3-2-19/h5-6,8-9,12,19H,2-4H2,1H3,(H,20,21)(H2,14,15,16)/t6-,8-,9-,12-/m1/s1