[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-(2-prop-2-enoylsulfanylethylamino)propyl]amino]butyl] 2,2-dimethylpropanoate
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![[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-(2-prop-2-enoylsulfanylethylamino)propyl]amino]butyl] 2,2-dimethylpropanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/4179963cf15c446d9ec8e0761ea2d69b.png "[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-(2-prop-2-enoylsulfanylethylamino)propyl]amino]butyl] 2,2-dimethylpropanoate")
[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-(2-prop-2-enoylsulfanylethylamino)propyl]amino]butyl] 2,2-dimethylpropanoate
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CAS No:
119072-36-5
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Formula:
C19H32N2O6S
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Chemical Name:
[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-(2-prop-2-enoylsulfanylethylamino)propyl]amino]butyl] 2,2-dimethylpropanoate
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Synonyms:
acryl-S-pantetheine-11-pivalate;acryl-SPP;119072-36-5;Acryl-spp;Acryl-S-pantetheine-11-pivalate;DTXSID50922864;4-[(2,2-Dimethylpropanoyl)oxy]-2-hydroxy-N-[3-hydroxy-3-({2-[(prop-2-enoyl)sulfanyl]ethyl}imino)propyl]-3,3-dimethylbutanimidic acid
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CAS No:
[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-(2-prop-2-enoylsulfanylethylamino)propyl]amino]butyl] 2,2-dimethylpropanoate Basic Attributes
416.5 g/mol
416.19810792 g/mol
Computed Properties
Molecular Weight:416.5
XLogP3:1.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:14
Exact Mass:416.19810792
Monoisotopic Mass:416.19810792
Topological Polar Surface Area:147
Heavy Atom Count:28
Complexity:584
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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