N-[6-hexadecoxy-9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-2-yl]-2-methyl-propanamide

Systemtic Name: N-[6-hexadecoxy-9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-2-yl]-2-methyl-propanamide Openeye Name: N-[9-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-6-hexadecoxy-purin-2-yl]-2-methyl-propanamide CAS Name: N-[9-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-6-hexadecoxy-2-purinyl]-2-methylpropanamide IUPAC Name: N-[9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-hexadecoxypurin-2-yl]-2-methylpropanamide Traditional Name: N-[6-cetyloxy-9-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)purin-2-yl]-2-methyl-propionamide Formula: C30H51N5O6 MolecularWeight: 577.75584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=NC(=NC2=C1N=CN2C3C(C(C(O3)CO)O)O)NC(=O)C(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=NC(=NC2=C1N=CN2C3C(C(C(O3)CO)O)O)NC(=O)C(C)C

InChI

InChI=1S/C30H51N5O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-40-28-23-26(32-30(34-28)33-27(39)21(2)3)35(20-31-23)29-25(38)24(37)22(19-36)41-29/h20-22,24-25,29,36-38H,4-19H2,1-3H3,(H,32,33,34,39)