(2S)-2-(butanoylamino)butanedioic acid
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(2S)-2-(butanoylamino)butanedioic acid
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CAS No:
1116-09-2
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Formula:
C8H13NO5
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Chemical Name:
(2S)-2-(butanoylamino)butanedioic acid
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Synonyms:
BRN 4311125;n-butanoyl-l-aspartic acid;N-Butyryl-DL-aspartic acid;1116-09-2;N-(1-Oxobutyl)-DL-aspartic acid;DL-Aspartic acid, N-(1-oxobutyl)-;N-(1-Oxobutyl)-L-aspartic acid;L-Aspartic acid, N-(1-oxobutyl)-;(2S)-2-(butanoylamino)butanedioic acid;SCHEMBL12426671;DTXSID00912235;N-(1-Hydroxybutylidene)aspartic acid;AKOS020220772;130056-59-6
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CAS No:
Computed Properties
Molecular Weight:203.19
XLogP3:-0.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:203.07937252
Monoisotopic Mass:203.07937252
Topological Polar Surface Area:104
Heavy Atom Count:14
Complexity:238
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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