Formula |
C22H35BN4O5 |
IUPAC Name |
[(1r)-1-[[(2s)-1-[(2r)-2-acetamido-3-phenyl-propanoyl]pyrrolidine-2-carbonyl]amino]-6-amino-hexyl]boronic acid |
Molecular Mass |
446.348 g·mol−1 |
Heat of Formation |
-1211.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.33 ± 1.08 D |
Volume |
563.11 Å 3 |
Surface Area |
481.28 Å 2 |
HOMO Energy |
-9.29 ± 0.55 eV |
LUMO Energy |
3.04 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- [(1r)-1-[[(2s)-1-[(2r)-2-acetamido-3-phenyl-propanoyl]pyrrolidin-2-yl]carbonylamino]-6-amino-hexyl]boronic acid
- [(1r)-1-[[(2s)-1-[(2r)-2-acetamido-3-phenyl-propanoyl]pyrrolidine-2-carbonyl]amino]-6-amino-hexyl]boronic acid
- [(1r)-1-[[(2s)-1-[(2r)-2-acetamido-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-6-aminohexyl]boronic acid
- [(1r)-1-[[[(2s)-1-[(2r)-2-acetamido-1-oxo-3-phenylpropyl]-2-pyrrolidinyl]-oxomethyl]amino]-6-aminohexyl]boronic acid
- di4
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InChIKey |
AILSWIBFGYYZTK-AABGKKOBSA-N |
QR Code |
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Links |
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Elements |
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