2-azanyl-9-[5-(19-octadecoxyheptatriacontan-19-yl)-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[5-(19-octadecoxyheptatriacontan-19-yl)-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[4-hydroxy-5-(1-octadecoxy-1-octadecyl-nonadecyl)tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-amino-9-[4-hydroxy-5-(19-octadecoxyheptatriacontan-19-yl)-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[4-hydroxy-5-(19-octadecoxyheptatriacontan-19-yl)oxolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[4-hydroxy-5-(1-stearyl-1-stearyloxy-nonadecyl)tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C64H121N5O4 MolecularWeight: 1024.67664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCCCC)(C1C(CC(O1)N2C=NC3=C2NC(=NC3=O)N)O)OCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCCCC)(C1C(CC(O1)N2C=NC3=C2NC(=NC3=O)N)O)OCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C64H121N5O4/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-64(53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2,72-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)60-57(70)55-58(73-60)69-56-66-59-61(69)67-63(65)68-62(59)71/h56-58,60,70H,4-55H2,1-3H3,(H3,65,67,68,71)