sodium;[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl [2-ethoxy-3-(octadecanoylamino)propyl] phosphate
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sodium;[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl [2-ethoxy-3-(octadecanoylamino)propyl] phosphate
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CAS No:
131933-67-0
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Formula:
C33H58N6NaO9P
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Chemical Name:
sodium;[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl [2-ethoxy-3-(octadecanoylamino)propyl] phosphate
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Synonyms:
1-octadecanamido-2-(ethoxypropyl)-rac-3-phospho-3'-azido-3'-deoxythymidine;3'-azido-3'-deoxy-5'-(3-octadecanamido-2-ethoxypropyl)phosphothymidine;3-ADPEPT;CP 92;CP-92;3-Adpept;CP 92;131933-67-0;CHEMBL3350978;CP-92;1-Octadecanamido-2-(ethoxypropyl)-rac-3-phospho-3'-azido-3'-deoxythymidine;3'-Azido-3'-deoxy-5'-(3-octadecanamido-2-ethoxypropyl)phosphothymidine;5'-Thymidylic acid, 3'-azido-3'-deoxy-, mono(2-ethoxy-3-((1-oxooctadecyl)amino)propyl) ester, monosodium salt
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CAS No:
sodium;[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl [2-ethoxy-3-(octadecanoylamino)propyl] phosphate Basic Attributes
736.8 g/mol
736.39005873 g/mol
Computed Properties
Molecular Weight:736.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:28
Exact Mass:736.39005873
Monoisotopic Mass:736.39005873
Topological Polar Surface Area:170
Heavy Atom Count:50
Complexity:1130
Defined Atom Stereocenter Count:3
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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