Formula |
C11H21N3O5S |
IUPAC Name |
(2s)-2-[[(2s)-2-[[(2s)-2-amino-4-methylsulfanyl-butanoyl]amino]propanoyl]amino]-3-hydroxy-propanoic acid |
Molecular Mass |
307.367 g·mol−1 |
Heat of Formation |
-967.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.94 ± 1.08 D |
Volume |
380.95 Å 3 |
Surface Area |
321.04 Å 2 |
HOMO Energy |
-8.33 ± 0.55 eV |
LUMO Energy |
0.40 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2s)-2-[[(2s)-2-[[(2s)-2-amino-4-(methylthio)-1-oxobutyl]amino]-1-oxopropyl]amino]-3-hydroxypropanoic acid
- (2s)-2-[[(2s)-2-[[(2s)-2-amino-4-(methylthio)butanoyl]amino]propanoyl]amino]-3-hydroxy-propionic acid
- (2s)-2-[[(2s)-2-[[(2s)-2-amino-4-methylsulfanyl-butanoyl]amino]propanoyl]amino]-3-hydroxy-propanoic acid
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InChIKey |
WXHHTBVYQOSYSL-FXQIFTODSA-N |
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Links |
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DOI |
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Elements |
H
S
C
O
N
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