2-azanyl-9-[[6-methoxy-3,4,5-tris(oxidanyl)oxan-2-yl]methoxymethyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[[6-methoxy-3,4,5-tris(oxidanyl)oxan-2-yl]methoxymethyl]-3H-purin-6-one Openeye Name: 2-amino-9-[(3,4,5-trihydroxy-6-methoxy-tetrahydropyran-2-yl)methoxymethyl]-3H-purin-6-one CAS Name: 2-amino-9-[(3,4,5-trihydroxy-6-methoxy-2-oxanyl)methoxymethyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(3,4,5-trihydroxy-6-methoxyoxan-2-yl)methoxymethyl]-3H-purin-6-one Traditional Name: 2-amino-9-[(3,4,5-trihydroxy-6-methoxy-tetrahydropyran-2-yl)methoxymethyl]-3H-purin-6-one Formula: C13H19N5O7 MolecularWeight: 357.31926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(C(C(O1)COCN2C=NC3=C2NC(=NC3=O)N)O)O)O

Isomeric SMILES

COC1C(C(C(C(O1)COCN2C=NC3=C2NC(=NC3=O)N)O)O)O

InChI

InChI=1S/C13H19N5O7/c1-23-12-9(21)8(20)7(19)5(25-12)2-24-4-18-3-15-6-10(18)16-13(14)17-11(6)22/h3,5,7-9,12,19-21H,2,4H2,1H3,(H3,14,16,17,22)