3-[(2R,3R,4R,5S,6R)-2-butoxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]-1-methyl-1-nitrosourea
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![3-[(2R,3R,4R,5S,6R)-2-butoxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]-1-methyl-1-nitrosourea structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/05956d1b06524f3c8977529ec0a92327.png "3-[(2R,3R,4R,5S,6R)-2-butoxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]-1-methyl-1-nitrosourea")
3-[(2R,3R,4R,5S,6R)-2-butoxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]-1-methyl-1-nitrosourea
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CAS No:
53347-37-8
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Formula:
C12H23N3O7
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Chemical Name:
3-[(2R,3R,4R,5S,6R)-2-butoxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]-1-methyl-1-nitrosourea
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Synonyms:
beta-Butylstreptozotocin;53347-37-8;CHEMBL3272423;beta-D-Butyl 2-deoxy-2-(3-methyl-3-nitrosoureido)glucopyranoside;Glucopyranoside, butyl 2-deoxy-2-(3-methyl-3-nitrosoureido)-, beta-D-;beta-D-Glucopyranoside, butyl 2-deoxy-2-(((methylnitrosoamino)carbonyl)amino)- (9CI)
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CAS No:
3-[(2R,3R,4R,5S,6R)-2-butoxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]-1-methyl-1-nitrosourea Basic Attributes
321.33 g/mol
321.15360008 g/mol
Computed Properties
Molecular Weight:321.33
XLogP3:0.3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:321.15360008
Monoisotopic Mass:321.15360008
Topological Polar Surface Area:141
Heavy Atom Count:22
Complexity:371
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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