2-azanyl-9-[5-[(E)-3-methoxy-3-oxidanyl-prop-2-enoyl]-3,4-bis(oxidanyl)oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[5-[(E)-3-methoxy-3-oxidanyl-prop-2-enoyl]-3,4-bis(oxidanyl)oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[3,4-dihydroxy-5-[(E)-3-hydroxy-3-methoxy-prop-2-enoyl]tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-amino-9-[3,4-dihydroxy-5-[(E)-3-hydroxy-3-methoxy-1-oxoprop-2-enyl]-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[3,4-dihydroxy-5-[(E)-3-hydroxy-3-methoxyprop-2-enoyl]oxolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[3,4-dihydroxy-5-[(E)-3-hydroxy-3-methoxy-acryloyl]tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C13H15N5O7 MolecularWeight: 353.2875

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Descriptors Computed from Structure

Canonical SMILES:

COC(=CC(=O)C1C(C(C(O1)N2C=NC3=C2NC(=NC3=O)N)O)O)O

Isomeric SMILES

CO/C(=C/C(=O)C1C(C(C(O1)N2C=NC3=C2NC(=NC3=O)N)O)O)/O

InChI

InChI=1S/C13H15N5O7/c1-24-5(20)2-4(19)9-7(21)8(22)12(25-9)18-3-15-6-10(18)16-13(14)17-11(6)23/h2-3,7-9,12,20-22H,1H3,(H3,14,16,17,23)/b5-2+