2-azanyl-9-[(1R,4S)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-3H-purin-6-one; (E)-6-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-4-methyl-hex-4-enoic acid

Systemtic Name: 2-azanyl-9-[(1R,4S)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-3H-purin-6-one; (E)-6-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-4-methyl-hex-4-enoic acid Openeye Name: 2-amino-9-[(1R,4S)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-3H-purin-6-one; (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-hex-4-enoic acid CAS Name: 2-amino-9-[(1R,4S)-4-(hydroxymethyl)-1-cyclopent-2-enyl]-3H-purin-6-one; (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-4-hexenoic acid IUPAC Name: 2-amino-9-[(1R,4S)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-3H-purin-6-one; (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoic acid Traditional Name: 2-amino-9-[(1R,4S)-4-methylolcyclopent-2-en-1-yl]-3H-purin-6-one; (E)-6-(4-hydroxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl)-4-methyl-hex-4-enoic acid Formula: C28H33N5O8 MolecularWeight: 567.59032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CCC(=O)O)OC.C1C(C=CC1N2C=NC3=C2NC(=NC3=O)N)CO

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)O)C/C=C(\C)/CCC(=O)O)OC.C1[C@@H](C=C[C@@H]1N2C=NC3=C2NC(=NC3=O)N)CO

InChI

InChI=1S/C17H20O6.C11H13N5O2/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3;12-11-14-9-8(10(18)15-11)13-5-16(9)7-2-1-6(3-7)4-17/h4,20H,5-8H2,1-3H3,(H,18,19);1-2,5-7,17H,3-4H2,(H3,12,14,15,18)/b9-4+;/t;6-,7+/m.1/s1