2-azanyl-3-oxidanylidene-5-(6-oxidanylidene-3H-purin-9-yl)-2-[(5-oxidanyl-1H-indol-3-yl)methyl]pentanoic acid

Systemtic Name: 2-azanyl-3-oxidanylidene-5-(6-oxidanylidene-3H-purin-9-yl)-2-[(5-oxidanyl-1H-indol-3-yl)methyl]pentanoic acid Openeye Name: 2-amino-2-[(5-hydroxy-1H-indol-3-yl)methyl]-3-oxo-5-(6-oxo-3H-purin-9-yl)pentanoic acid CAS Name: 2-amino-2-[(5-hydroxy-1H-indol-3-yl)methyl]-3-oxo-5-(6-oxo-3H-purin-9-yl)pentanoic acid IUPAC Name: 2-amino-2-[(5-hydroxy-1H-indol-3-yl)methyl]-3-oxo-5-(6-oxo-3H-purin-9-yl)pentanoic acid Traditional Name: 2-amino-2-[(5-hydroxy-1H-indol-3-yl)methyl]-3-keto-5-(6-keto-3H-purin-9-yl)valeric acid Formula: C19H18N6O5 MolecularWeight: 410.38342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)C(=CN2)CC(C(=O)CCN3C=NC4=C3NC=NC4=O)(C(=O)O)N

Isomeric SMILES

C1=CC2=C(C=C1O)C(=CN2)CC(C(=O)CCN3C=NC4=C3NC=NC4=O)(C(=O)O)N

InChI

InChI=1S/C19H18N6O5/c20-19(18(29)30,6-10-7-21-13-2-1-11(26)5-12(10)13)14(27)3-4-25-9-24-15-16(25)22-8-23-17(15)28/h1-2,5,7-9,21,26H,3-4,6,20H2,(H,29,30)(H,22,23,28)