[1-[2,3-dihydroxy-4-[4-(oxoazaniumylmethylidene)pyridin-1-yl]butyl]pyridin-4-ylidene]methyl-oxoazanium,dinitrate
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![[1-[2,3-dihydroxy-4-[4-(oxoazaniumylmethylidene)pyridin-1-yl]butyl]pyridin-4-ylidene]methyl-oxoazanium,dinitrate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/9291c3060c5b4e41a022d3e86a33c956.png "[1-[2,3-dihydroxy-4-[4-(oxoazaniumylmethylidene)pyridin-1-yl]butyl]pyridin-4-ylidene]methyl-oxoazanium,dinitrate")
[1-[2,3-dihydroxy-4-[4-(oxoazaniumylmethylidene)pyridin-1-yl]butyl]pyridin-4-ylidene]methyl-oxoazanium,dinitrate
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CAS No:
1102-70-1
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Formula:
C16H20N6O10
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Chemical Name:
[1-[2,3-dihydroxy-4-[4-(oxoazaniumylmethylidene)pyridin-1-yl]butyl]pyridin-4-ylidene]methyl-oxoazanium,dinitrate
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Synonyms:
[1-[2,3-dihydroxy-4-[4-(oxoazaniumylmethylidene)pyridin-1-yl]butyl]pyridin-4-ylidene]methyl-oxoazanium dinitrate; 1,4-Bis(4-hydroxyiminomethyl-pyridinium-(1))-butanediol(2,3)-dinitrat [German]; R 45; 1,4-Bis(4-hydroxyiminomethyl-pyridinium-(1))-butanediol(2,3)-dinitrat; Pyridinium,1,1'-(2,3-dihydroxytetramethylene)bis(4-formyl-,dinitrate,dioxime;
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CAS No:
[1-[2,3-dihydroxy-4-[4-(oxoazaniumylmethylidene)pyridin-1-yl]butyl]pyridin-4-ylidene]methyl-oxoazanium,dinitrate Basic Attributes
456.36400
456.12409086
Computed Properties
Molecular Weight:456.36
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:7
Exact Mass:456.12409086
Monoisotopic Mass:456.12409086
Topological Polar Surface Area:239
Heavy Atom Count:32
Complexity:386
Undefined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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