2-methyl-5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoic acid
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![2-methyl-5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/b5923468b4f64db7af6ab512d99994df.png "2-methyl-5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoic acid")
2-methyl-5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoic acid
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CAS No:
30868-27-0
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Formula:
C11H18N2O3S
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Chemical Name:
2-methyl-5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoic acid
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Synonyms:
alpha-methylbiotin;alpha-Methylbiotin;NSC145151;Biotin, .alpha.-methyl-;30868-27-0;2-Methyl-5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoic acid;2-methyl-5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoic acid;NSC-145151;CHEMBL1970533;DTXSID70953054;NCI60_000979;FT-0671556;1H-Thieno(3,4-d)imidazole-4-pentanoic acid, hexahydro-alpha-methyl-2-oxo-;5-(2-Hydroxy-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-6-yl)-2-methylpentanoic acid
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CAS No:
2-methyl-5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoic acid Basic Attributes
258.34 g/mol
258.10381361 g/mol
145151
Computed Properties
Molecular Weight:258.34
XLogP3:0.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:258.10381361
Monoisotopic Mass:258.10381361
Topological Polar Surface Area:104
Heavy Atom Count:17
Complexity:324
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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