azane; [(2S)-1-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-propan-2-yl]oxymethyl-(3-hexadec-15-enoxypropoxy)phosphinic acid

Systemtic Name: azane; [(2S)-1-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-propan-2-yl]oxymethyl-(3-hexadec-15-enoxypropoxy)phosphinic acid Openeye Name: [(1S)-1-[(4-amino-2-oxo-pyrimidin-1-yl)methyl]-2-hydroxy-ethoxy]methyl-(3-hexadec-15-enoxypropoxy)phosphinic acid; ammonia CAS Name: [(2S)-1-(4-amino-2-oxo-1-pyrimidinyl)-3-hydroxypropan-2-yl]oxymethyl-(3-hexadec-15-enoxypropoxy)phosphinic acid; ammonia IUPAC Name: [(2S)-1-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxypropan-2-yl]oxymethyl-(3-hexadec-15-enoxypropoxy)phosphinic acid; azane Traditional Name: [(1S)-1-[(4-amino-2-keto-pyrimidin-1-yl)methyl]-2-hydroxy-ethoxy]methyl-(3-hexadec-15-enoxypropoxy)phosphinic acid; ammonia Formula: C27H53N4O7P MolecularWeight: 576.706081

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCCCCCCCCCCCOCCCOP(=O)(COC(CN1C=CC(=NC1=O)N)CO)O.N

Isomeric SMILES

C=CCCCCCCCCCCCCCCOCCCOP(=O)(CO[C@@H](CN1C=CC(=NC1=O)N)CO)O.N

InChI

InChI=1S/C27H50N3O7P.H3N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-35-20-16-21-37-38(33,34)24-36-25(23-31)22-30-18-17-26(28)29-27(30)32;/h2,17-18,25,31H,1,3-16,19-24H2,(H,33,34)(H2,28,29,32);1H3/t25-;/m0./s1