[3-oxidanyl-2-(purin-7-ylmethoxy)propyl] octadecanoate

Systemtic Name: [3-oxidanyl-2-(purin-7-ylmethoxy)propyl] octadecanoate Openeye Name: [3-hydroxy-2-(purin-7-ylmethoxy)propyl] octadecanoate CAS Name: octadecanoic acid [3-hydroxy-2-(7-purinylmethoxy)propyl] ester IUPAC Name: [3-hydroxy-2-(purin-7-ylmethoxy)propyl] octadecanoate Traditional Name: stearic acid [3-hydroxy-2-(purin-7-ylmethoxy)propyl] ester Formula: C27H46N4O4 MolecularWeight: 490.67854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(CO)OCN1C=NC2=NC=NC=C21

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(CO)OCN1C=NC2=NC=NC=C21

InChI

InChI=1S/C27H46N4O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26(33)34-20-24(19-32)35-23-31-22-30-27-25(31)18-28-21-29-27/h18,21-22,24,32H,2-17,19-20,23H2,1H3