[1-[5-(6-aminopurin-9-yl)-3-ethanoyl-3-oxidanyl-oxolan-2-yl]-2-oxidanylidene-propyl] 2,6-bis(azanyl)hexanoate

Systemtic Name: [1-[5-(6-aminopurin-9-yl)-3-ethanoyl-3-oxidanyl-oxolan-2-yl]-2-oxidanylidene-propyl] 2,6-bis(azanyl)hexanoate Openeye Name: [1-[3-acetyl-5-(6-aminopurin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]-2-oxo-propyl] 2,6-diaminohexanoate CAS Name: 2,6-diaminohexanoic acid [1-[3-acetyl-5-(6-aminopurin-9-yl)-3-hydroxy-2-oxolanyl]-2-oxopropyl] ester IUPAC Name: [1-[3-acetyl-5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]-2-oxopropyl] 2,6-diaminohexanoate Traditional Name: 2,6-diaminohexanoic acid [1-(3-acetyl-5-adenin-9-yl-3-hydroxy-tetrahydrofuran-2-yl)-2-keto-propyl] ester Formula: C20H29N7O6 MolecularWeight: 463.48756

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C1C(CC(O1)N2C=NC3=C2N=CN=C3N)(C(=O)C)O)OC(=O)C(CCCCN)N

Isomeric SMILES

CC(=O)C(C1C(CC(O1)N2C=NC3=C2N=CN=C3N)(C(=O)C)O)OC(=O)C(CCCCN)N

InChI

InChI=1S/C20H29N7O6/c1-10(28)15(33-19(30)12(22)5-3-4-6-21)16-20(31,11(2)29)7-13(32-16)27-9-26-14-17(23)24-8-25-18(14)27/h8-9,12-13,15-16,31H,3-7,21-22H2,1-2H3,(H2,23,24,25)