6-[[2-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3,5-dioxo-1,2,4-triazin-6-yl]sulfanyl]hexanoic acid
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![6-[[2-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3,5-dioxo-1,2,4-triazin-6-yl]sulfanyl]hexanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/df7b534a4c5a47b78265afb76e7ddd31.png "6-[[2-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3,5-dioxo-1,2,4-triazin-6-yl]sulfanyl]hexanoic acid")
6-[[2-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3,5-dioxo-1,2,4-triazin-6-yl]sulfanyl]hexanoic acid
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CAS No:
84608-20-8
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Formula:
C14H21N3O8S
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Chemical Name:
6-[[2-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3,5-dioxo-1,2,4-triazin-6-yl]sulfanyl]hexanoic acid
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Synonyms:
NSC306883;84608-20-8;DTXSID00316799;NSC-306883;DS-001570;Hexanoic acid,6-[(2,3,4,5-tetrahydro-3,5-dioxo-2-b-d-ribofuranosyl-1,2,4-triazin-6-yl)thio]-
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CAS No:
6-[[2-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3,5-dioxo-1,2,4-triazin-6-yl]sulfanyl]hexanoic acid Basic Attributes
391.40 g/mol
391.10493581 g/mol
306883
DTXSID00316799
Computed Properties
Molecular Weight:391.40
XLogP3:-0.6
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:9
Exact Mass:391.10493581
Monoisotopic Mass:391.10493581
Topological Polar Surface Area:194
Heavy Atom Count:26
Complexity:587
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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