2-azanyl-9-[(3S,4R)-4-methoxy-3,5-bis(oxidanyl)pentyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[(3S,4R)-4-methoxy-3,5-bis(oxidanyl)pentyl]-3H-purin-6-one Openeye Name: 2-amino-9-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-3H-purin-6-one CAS Name: 2-amino-9-[(3S,4R)-3,5-dihydroxy-4-methoxypentyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(3S,4R)-3,5-dihydroxy-4-methoxypentyl]-3H-purin-6-one Traditional Name: 2-amino-9-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-3H-purin-6-one Formula: C11H17N5O4 MolecularWeight: 283.28378

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Descriptors Computed from Structure

Canonical SMILES:

COC(CO)C(CCN1C=NC2=C1NC(=NC2=O)N)O

Isomeric SMILES

CO[C@H](CO)[C@H](CCN1C=NC2=C1NC(=NC2=O)N)O

InChI

InChI=1S/C11H17N5O4/c1-20-7(4-17)6(18)2-3-16-5-13-8-9(16)14-11(12)15-10(8)19/h5-7,17-18H,2-4H2,1H3,(H3,12,14,15,19)/t6-,7+/m0/s1