2-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]oxyethyl pyridine-3-carboxylate
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![2-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]oxyethyl pyridine-3-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/ba10c0c740f2420c9b43b7e517b843c2.png "2-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]oxyethyl pyridine-3-carboxylate")
2-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]oxyethyl pyridine-3-carboxylate
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CAS No:
61379-43-9
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Formula:
C17H17N5O6
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Chemical Name:
2-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]oxyethyl pyridine-3-carboxylate
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Synonyms:
(theophyllin-7-yl)-methylcarboyloxy-2-(nicotinoyloxy)-ethane; (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-purin-7-yl)-acetic acid 2-nicotinoyloxy-ethyl ester; 1-(Theophyllinyl-7-methyenecarboxyloxy)-2-(nicotinoyl)ethane; 7H-Purine-7-acetic acid,1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-,2-((3-pyridinylcarbonyl)oxy)ethyl ester;
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CAS No:
2-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]oxyethyl pyridine-3-carboxylate Basic Attributes
387.34700
387.11788328
Computed Properties
Molecular Weight:387.3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:387.11788328
Monoisotopic Mass:387.11788328
Topological Polar Surface Area:124
Heavy Atom Count:28
Complexity:644
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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