Formula |
C23H33N2O6PS |
IUPAC Name |
(2s)-2-[3-(aminomethyl)phenyl]-3-[hydroxy-[(1r)-2-methyl-1-(3-phenylpropylsulfonylamino)propyl]phosphoryl]propanoic acid |
Molecular Mass |
496.557 g·mol−1 |
Heat of Formation |
-1173.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.69 ± 1.08 D |
Volume |
589.51 Å 3 |
Surface Area |
493.18 Å 2 |
HOMO Energy |
-8.71 ± 0.55 eV |
LUMO Energy |
2.78 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2s)-2-[3-(aminomethyl)phenyl]-3-[hydroxy-[(1r)-2-methyl-1-(3-phenylpropylsulfonylamino)propyl]phosphoryl]propanoic acid
- (2s)-2-[3-(aminomethyl)phenyl]-3-[hydroxy-[(1r)-2-methyl-1-(3-phenylpropylsulfonylamino)propyl]phosphoryl]propionic acid
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InChIKey |
WFFOOKSVFDUPDH-FCHUYYIVSA-N |
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Links |
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DOI |
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Downloads |
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Elements |
C
H
O
N
P
S
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