4-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-oxido-1,2,4-triazin-1-ium-3-one
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4-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-oxido-1,2,4-triazin-1-ium-3-one
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CAS No:
40919-33-3
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Formula:
C8H11N3O6
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Chemical Name:
4-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-oxido-1,2,4-triazin-1-ium-3-one
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Synonyms:
4-beta-D-ribofuranosyl-as-triazin-3(4H)-one 1-oxide;Uricytin;4-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-oxido-1,2,4-triazin-1-ium-3-one;1,2,4-Triazin-3(4H)-one, 4-beta-D-ribofuranosyl-, 1-oxide;40919-33-3;NSC 177248;4-beta-D-Ribofuranosyl-as-triazin-3(4H)-one 1-oxide
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CAS No:
4-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-oxido-1,2,4-triazin-1-ium-3-one Basic Attributes
245.19 g/mol
245.06478508 g/mol
177248
Computed Properties
Molecular Weight:245.19
XLogP3:-2.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:245.06478508
Monoisotopic Mass:245.06478508
Topological Polar Surface Area:131
Heavy Atom Count:17
Complexity:384
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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