Formula |
C28H32N2O5 |
IUPAC Name |
(2r)-2-[[1-[[(1s)-1-carboxy-2-(1h-indol-3-yl)ethyl]carbamoyl]cyclopentyl]methyl]-4-phenyl-butanoic acid |
Molecular Mass |
476.564 g·mol−1 |
Heat of Formation |
469.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
10.73 ± 1.08 D |
Volume |
595.25 Å 3 |
Surface Area |
461.46 Å 2 |
HOMO Energy |
-5.54 ± 0.55 eV |
LUMO Energy |
-4.53 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2r)-2-[[1-[[(1s)-2-hydroxy-1-(1h-indol-3-ylmethyl)-2-keto-ethyl]carbamoyl]cyclopentyl]methyl]-4-phenyl-butyric acid
- (2r)-2-[[1-[[(1s)-2-hydroxy-1-(1h-indol-3-ylmethyl)-2-oxo-ethyl]carbamoyl]cyclopentyl]methyl]-4-phenyl-butanoic acid
- (2r)-2-[[1-[[(2s)-1-hydroxy-3-(1h-indol-3-yl)-1-oxo-propan-2-yl]carbamoyl]cyclopentyl]methyl]-4-phenyl-butanoic acid
- (2r)-2-[[1-[[(2s)-1-hydroxy-3-(1h-indol-3-yl)-1-oxopropan-2-yl]carbamoyl]cyclopentyl]methyl]-4-phenylbutanoic acid
- (2r)-2-[[1-[[[(1s)-2-hydroxy-1-(1h-indol-3-ylmethyl)-2-oxoethyl]amino]-oxomethyl]cyclopentyl]methyl]-4-phenylbutanoic acid
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InChIKey |
MPZIROHQGMKFGS-YKSBVNFPSA-N |
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Links |
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Elements |
H
C
O
N
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