2-azanyl-9-[3,4-diethanoyl-3,4-bis(oxidanyl)-5-(1-oxidanyl-2-oxidanylidene-propyl)oxolan-2-yl]-8-ethenyl-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[3,4-diethanoyl-3,4-bis(oxidanyl)-5-(1-oxidanyl-2-oxidanylidene-propyl)oxolan-2-yl]-8-ethenyl-3H-purin-6-one Openeye Name: 2-amino-9-[3,4-diacetyl-3,4-dihydroxy-5-(1-hydroxy-2-oxo-propyl)tetrahydrofuran-2-yl]-8-vinyl-3H-purin-6-one CAS Name: 2-amino-9-[3,4-diacetyl-3,4-dihydroxy-5-(1-hydroxy-2-oxopropyl)-2-oxolanyl]-8-ethenyl-3H-purin-6-one IUPAC Name: 2-amino-9-[3,4-diacetyl-3,4-dihydroxy-5-(1-hydroxy-2-oxopropyl)oxolan-2-yl]-8-ethenyl-3H-purin-6-one Traditional Name: 2-amino-9-[3,4-diacetyl-3,4-dihydroxy-5-(1-hydroxy-2-keto-propyl)tetrahydrofuran-2-yl]-8-vinyl-3H-purin-6-one Formula: C18H21N5O8 MolecularWeight: 435.38804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N5O8/c1-5-9-20-10-13(21-16(19)22-14(10)28)23(9)15-18(30,8(4)26)17(29,7(3)25)12(31-15)11(27)6(2)24/h5,11-12,15,27,29-30H,1H2,2-4H3,(H3,19,21,22,28)