Formula |
C20H30N6O4 |
IUPAC Name |
(2s)-2-[[(2s)-1-[(2s)-2-amino-3-phenyl-propanoyl]pyrrolidine-2-carbonyl]amino]-5-guanidino-pentanoic acid |
Molecular Mass |
418.490 g·mol−1 |
Heat of Formation |
-686.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.16 ± 1.08 D |
Volume |
506.4 Å 3 |
Surface Area |
383.9 Å 2 |
HOMO Energy |
-9.32 ± 0.55 eV |
LUMO Energy |
0.22 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2s)-2-[[(2s)-1-[(2s)-2-amino-3-phenyl-propanoyl]pyrrolidin-2-yl]carbonylamino]-5-(diaminomethylideneamino)pentanoic acid
- (2s)-2-[[(2s)-1-[(2s)-2-amino-3-phenyl-propanoyl]pyrrolidine-2-carbonyl]amino]-5-guanidino-pentanoic acid
- (2s)-2-[[(2s)-1-[(2s)-2-amino-3-phenyl-propanoyl]pyrrolidine-2-carbonyl]amino]-5-guanidino-valeric acid
- (2s)-2-[[(2s)-1-[(2s)-2-amino-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-5-(diaminomethylideneamino)pentanoic acid
- (2s)-2-[[[(2s)-1-[(2s)-2-amino-1-oxo-3-phenylpropyl]-2-pyrrolidinyl]-oxomethyl]amino]-5-guanidinopentanoic acid
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InChIKey |
NTUPOKHATNSWCY-JYJNAYRXSA-N |
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Elements |
H
C
O
N
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