azane; [5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl (3-octadecoxy-2-oxidanyl-propyl) hydrogen phosphate

Systemtic Name: azane; [5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl (3-octadecoxy-2-oxidanyl-propyl) hydrogen phosphate Openeye Name: [5-(4-amino-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl (2-hydroxy-3-octadecoxy-propyl) hydrogen phosphate; ammonia CAS Name: [5-(4-amino-2-oxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]methyl (2-hydroxy-3-octadecoxypropyl) hydrogen phosphate; ammonia IUPAC Name: [5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl (2-hydroxy-3-octadecoxypropyl) hydrogen phosphate; azane Traditional Name: [5-(4-amino-2-keto-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl (2-hydroxy-3-stearyloxy-propyl) hydrogen phosphate; ammonia Formula: C30H59N4O10P MolecularWeight: 666.784021

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COP(=O)(O)OCC1C(C(C(O1)N2C=CC(=NC2=O)N)O)O)O.N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COP(=O)(O)OCC1C(C(C(O1)N2C=CC(=NC2=O)N)O)O)O.N

InChI

InChI=1S/C30H56N3O10P.H3N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-40-21-24(34)22-41-44(38,39)42-23-25-27(35)28(36)29(43-25)33-19-18-26(31)32-30(33)37;/h18-19,24-25,27-29,34-36H,2-17,20-23H2,1H3,(H,38,39)(H2,31,32,37);1H3