Formula |
C17H25NO4S |
IUPAC Name |
(2s)-3-(4-methoxyphenyl)-2-[[(2s)-4-methyl-2-(sulfanylmethyl)pentanoyl]amino]propanoic acid |
Molecular Mass |
339.450 g·mol−1 |
Heat of Formation |
-781.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
1.17 ± 1.08 D |
Volume |
424.99 Å 3 |
Surface Area |
350.35 Å 2 |
HOMO Energy |
-8.91 ± 0.55 eV |
LUMO Energy |
2.74 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2s)-2-[[(2s)-2-(mercaptomethyl)-4-methyl-1-oxopentyl]amino]-3-(4-methoxyphenyl)propanoic acid
- (2s)-2-[[(2s)-2-(mercaptomethyl)-4-methyl-pentanoyl]amino]-3-(4-methoxyphenyl)propionic acid
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InChIKey |
PRPWYZNFKBFGFI-HIFRSBDPSA-N |
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Links |
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Elements |
H
C
S
O
N
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