1-[5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-oxolan-2-yl]ethenyl octadecanoate

Systemtic Name: 1-[5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-oxolan-2-yl]ethenyl octadecanoate Openeye Name: 1-[5-(4-amino-2-oxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]vinyl octadecanoate CAS Name: octadecanoic acid 1-[5-(4-amino-2-oxo-1-pyrimidinyl)-3-hydroxy-2-oxolanyl]ethenyl ester IUPAC Name: 1-[5-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]ethenyl octadecanoate Traditional Name: stearic acid 1-[5-(4-amino-2-keto-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]vinyl ester Formula: C28H47N3O5 MolecularWeight: 505.68988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(=C)C1C(CC(O1)N2C=CC(=NC2=O)N)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(=C)C1C(CC(O1)N2C=CC(=NC2=O)N)O

InChI

InChI=1S/C28H47N3O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26(33)35-22(2)27-23(32)21-25(36-27)31-20-19-24(29)30-28(31)34/h19-20,23,25,27,32H,2-18,21H2,1H3,(H2,29,30,34)