Formula |
C33H47N5O7 |
IUPAC Name |
(2r)-2-[[(1s)-1-[[(1s)-1-benzyl-2-(2-morpholinoethylamino)-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]amino]-4-(benzyloxycarbonylamino)butanoic acid |
Molecular Mass |
625.756 g·mol−1 |
Heat of Formation |
-1211.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.37 ± 1.08 D |
Volume |
777.85 Å 3 |
Surface Area |
635.85 Å 2 |
HOMO Energy |
-8.94 ± 0.55 eV |
LUMO Energy |
-0.06 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2r)-2-[[(1s)-1-[[(1s)-1-(benzyl)-2-keto-2-(2-morpholinoethylamino)ethyl]carbamoyl]-3-methyl-butyl]amino]-4-(benzyloxycarbonylamino)butyric acid
- (2r)-2-[[(1s)-3-methyl-1-[[(1s)-2-(2-morpholinoethylamino)-2-oxo-1-(phenylmethyl)ethyl]carbamoyl]butyl]amino]-4-(phenylmethoxycarbonylamino)butanoic acid
- (2r)-2-[[(1s)-3-methyl-1-[[[(1s)-2-(2-morpholinoethylamino)-2-oxo-1-(phenylmethyl)ethyl]amino]-oxomethyl]butyl]amino]-4-[[oxo-(phenylmethoxy)methyl]amino]butanoic acid
- (2r)-2-[[(2s)-4-methyl-1-[[(2s)-1-(2-morpholin-4-ylethylamino)-1-oxo-3-phenyl-propan-2-yl]amino]-1-oxo-pentan-2-yl]amino]-4-(phenylmethoxycarbonylamino)butanoic acid
- (2r)-2-[[(2s)-4-methyl-1-[[(2s)-1-(2-morpholin-4-ylethylamino)-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopentan-2-yl]amino]-4-(phenylmethoxycarbonylamino)butanoic acid
- cbz-abu-leu-phe-emr
|
InChIKey |
XQSMAYNMHYYWCR-ULNSLHSMSA-N |
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Elements |
H
C
O
N
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