Formula |
C30H35N3O9P2 |
IUPAC Name |
[4-[(2s)-2-acetamido-3-oxo-3-[[(3s)-2-oxo-1-[(4-phenylphenyl)methyl]azepan-3-yl]amino]propyl]-2-phosphono-phenyl]phosphonic acid |
Molecular Mass |
643.561 g·mol−1 |
Heat of Formation |
-1929.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.48 ± 1.08 D |
Volume |
728.37 Å 3 |
Surface Area |
515.44 Å 2 |
HOMO Energy |
-8.99 ± 0.55 eV |
LUMO Energy |
-0.54 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- [5-[(2s)-2-acetamido-3-keto-3-[[(3s)-2-keto-1-(4-phenylbenzyl)azepan-3-yl]amino]propyl]-2-phosphono-phenyl]phosphonic acid
- [5-[(2s)-2-acetamido-3-oxo-3-[[(3s)-2-oxo-1-[(4-phenylphenyl)methyl]-3-azepanyl]amino]propyl]-2-phosphonophenyl]phosphonic acid
- [5-[(2s)-2-acetamido-3-oxo-3-[[(3s)-2-oxo-1-[(4-phenylphenyl)methyl]azepan-3-yl]amino]propyl]-2-phosphono-phenyl]phosphonic acid
- [5-[(2s)-2-acetamido-3-oxo-3-[[(3s)-2-oxo-1-[(4-phenylphenyl)methyl]azepan-3-yl]amino]propyl]-2-phosphonophenyl]phosphonic acid
- n-acetyl-n-[1-(1,1'-biphenyl-4-ylmethyl)-2-oxoazepan-3-yl]-3,4-diphosphonophenylalaninamide
- ru83876
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InChIKey |
WCMLXBUNHNAMNH-UIOOFZCWSA-N |
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Links |
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Elements |
P
C
H
O
N
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