N-Acetyl-S-({3-Hydroxy-2-[(1S)-1-Hydroxy-2-Methylpropyl]-4-Methyl-5-Oxo-2-Pyrrolidinyl}Carbonyl)Cysteine

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Formula C15H24N2O7S
IUPAC Name (2r)-2-acetamido-3-[(2r,3s,4r)-3-hydroxy-2-[(1s)-1-hydroxy-2-methyl-propyl]-4-methyl-5-oxo-pyrrolidine-2-carbonyl]sulfanyl-propanoic acid
Molecular Mass 376.425 g·mol−1
Heat of Formation -1345.2 ± 16.7 kJ·mol−1
Dipole Moment 5.80 ± 1.08 D
Volume 440.93 Å 3
Surface Area 358.9 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy -0.62 ± eV
Point Group Symmetry C1
InChIKey DAQAKHDKYAWHCG-UHUUSHTDSA-N
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