5′-Adenylic acid, compd. with 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline (1:1)
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![5′-Adenylic acid, compd. with 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline (1:1) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/da8bfb8c0cee4d09be97b2e026e29e63.png "5′-Adenylic acid, compd. with 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline (1:1)")
5′-Adenylic acid, compd. with 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline (1:1)
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CAS No:
39024-96-9
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Formula:
C20H21NO4.C10H14N5O7P
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Chemical Name:
5′-Adenylic acid, compd. with 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline (1:1)
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Synonyms:
5′-Adenylic acid,compd. with 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline (1:1);Isoquinoline,1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-,5′-adenylate;Dicertan;Papaverine monophosadenine;Papaverine adenylate
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CAS No:
5′-Adenylic acid, compd. with 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline (1:1) Basic Attributes
686.6 g/mol
686.21014295 g/mol
254-252-3
Computed Properties
Molecular Weight:686.6
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:16
Rotatable Bond Count:10
Exact Mass:686.21014295
Monoisotopic Mass:686.21014295
Topological Polar Surface Area:236
Heavy Atom Count:48
Complexity:888
Defined Atom Stereocenter Count:3
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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