5-(6-aminopurin-9-yl)-4-(1-anthracen-2-ylpropoxy)-2-(hydroxymethyl)oxolan-3-ol

Systemtic Name: 5-(6-aminopurin-9-yl)-4-(1-anthracen-2-ylpropoxy)-2-(hydroxymethyl)oxolan-3-ol Openeye Name: 5-(6-aminopurin-9-yl)-4-[1-(2-anthryl)propoxy]-2-(hydroxymethyl)tetrahydrofuran-3-ol CAS Name: 5-(6-aminopurin-9-yl)-4-[1-(2-anthracenyl)propoxy]-2-(hydroxymethyl)-3-oxolanol IUPAC Name: 5-(6-aminopurin-9-yl)-4-(1-anthracen-2-ylpropoxy)-2-(hydroxymethyl)oxolan-3-ol Traditional Name: 5-adenin-9-yl-4-[1-(2-anthryl)propoxy]-2-methylol-tetrahydrofuran-3-ol Formula: C27H27N5O4 MolecularWeight: 485.53438

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=CC3=CC=CC=C3C=C2C=C1)OC4C(C(OC4N5C=NC6=C5N=CN=C6N)CO)O

Isomeric SMILES

CCC(C1=CC2=CC3=CC=CC=C3C=C2C=C1)OC4C(C(OC4N5C=NC6=C5N=CN=C6N)CO)O

InChI

InChI=1S/C27H27N5O4/c1-2-20(18-8-7-17-9-15-5-3-4-6-16(15)10-19(17)11-18)35-24-23(34)21(12-33)36-27(24)32-14-31-22-25(28)29-13-30-26(22)32/h3-11,13-14,20-21,23-24,27,33-34H,2,12H2,1H3,(H2,28,29,30)