3-[(2,4-dihydroxy-3,3-dimethylpentanoyl)amino]propanoic acid
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![3-[(2,4-dihydroxy-3,3-dimethylpentanoyl)amino]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/bd66e6ab032a4f9a8e9b0f8ad15db3f3.png "3-[(2,4-dihydroxy-3,3-dimethylpentanoyl)amino]propanoic acid")
3-[(2,4-dihydroxy-3,3-dimethylpentanoyl)amino]propanoic acid
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CAS No:
2545-82-6
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Formula:
C10H19NO5
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Chemical Name:
3-[(2,4-dihydroxy-3,3-dimethylpentanoyl)amino]propanoic acid
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Synonyms:
omega-Methyl pantothenic acid;2545-82-6;3-[(2,4-dihydroxy-3,3-dimethylpentanoyl)amino]propanoic acid;N-(2,4-Dihydroxy-3,3-dimethyl-1-oxopentyl)-beta-alanine;beta-Alanine, N-(2,4-dihydroxy-3,3-dimethyl-1-oxopentyl)-;3-[(2,4-dihydroxy-3,3-dimethyl-pentanoyl)amino]propanoic acid;N-(alpha, gamma-Dihydroxy-beta, beta-dimethylvaleryl)-beta-alanine, sodium salt
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CAS No:
3-[(2,4-dihydroxy-3,3-dimethylpentanoyl)amino]propanoic acid Basic Attributes
233.26 g/mol
233.12632271 g/mol
Computed Properties
Molecular Weight:233.26
XLogP3:-0.6
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:233.12632271
Monoisotopic Mass:233.12632271
Topological Polar Surface Area:107
Heavy Atom Count:16
Complexity:264
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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