Formula |
C18H28N2O6S2 |
IUPAC Name |
(2r)-1-[(2s)-3-[[(2s)-3-[(2r)-2-carboxypyrrolidin-1-yl]-2-methyl-3-oxo-propyl]disulfanyl]-2-methyl-propanoyl]pyrrolidine-2-carboxylic acid |
Molecular Mass |
432.555 g·mol−1 |
Heat of Formation |
-1223.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.21 ± 1.08 D |
Volume |
512.28 Å 3 |
Surface Area |
371.84 Å 2 |
HOMO Energy |
-8.83 ± 0.55 eV |
LUMO Energy |
-0.94 ± eV |
Point Group Symmetry |
C2
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Synonyms
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- (2r)-1-[(2s)-3-[(2s)-3-[(2r)-2-carboxy-1-pyrrolidinyl]-2-methyl-3-oxopropyl]disulfanyl-2-methyl-1-oxopropyl]-2-pyrrolidinecarboxylic acid
- (2r)-1-[(2s)-3-[(2s)-3-[(2r)-2-carboxypyrrolidin-1-yl]-2-methyl-3-oxo-propyl]disulfanyl-2-methyl-propanoyl]pyrrolidine-2-carboxylic acid
- (2r)-1-[(2s)-3-[(2s)-3-[(2r)-2-carboxypyrrolidin-1-yl]-2-methyl-3-oxopropyl]disulfanyl-2-methylpropanoyl]pyrrolidine-2-carboxylic acid
- (2r)-1-[(2s)-3-[(2s)-3-[(2r)-2-carboxypyrrolidin-1-yl]-3-keto-2-methyl-propyl]disulfanyl-2-methyl-propanoyl]proline
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InChIKey |
ZWKRXBCJAUKDCI-AAVRWANBSA-N |
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Elements |
H
S
C
O
N
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