4-amino-1-[(6R,7R)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-heptylpyrimidin-2-one
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![4-amino-1-[(6R,7R)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-heptylpyrimidin-2-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/077e8a4b28334446a805c7bccfadcda0.png "4-amino-1-[(6R,7R)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-heptylpyrimidin-2-one")
4-amino-1-[(6R,7R)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-heptylpyrimidin-2-one
structure -
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CAS No:
117309-94-1
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Formula:
C16H26N3O7P
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Chemical Name:
4-amino-1-[(6R,7R)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-heptylpyrimidin-2-one
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Synonyms:
5-n-octylcytidine 3',5'-cyclic monophosphate ammonium salt; 5-n-Octylcytidine 3',5'-cyclic monophosphate;
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CAS No:
4-amino-1-[(6R,7R)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-heptylpyrimidin-2-one Basic Attributes
403.36700
403.15083717 g/mol
Computed Properties
Molecular Weight:403.37
XLogP3:0.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:403.15083717
Monoisotopic Mass:403.15083717
Topological Polar Surface Area:144
Heavy Atom Count:27
Complexity:683
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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