Formula |
C34H38N6O5 |
IUPAC Name |
(2s)-n-[(1s)-2-[[(1s)-2-amino-1-benzyl-2-oxo-ethyl]amino]-1-(2h-indol-1-ium-2-ylium-3-ylmethyl)-2-oxo-ethyl]-1-[(2s)-2-amino-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carboxamide |
Molecular Mass |
610.703 g·mol−1 |
Heat of Formation |
-614.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.04 ± 1.08 D |
Volume |
771.58 Å 3 |
Surface Area |
526.37 Å 2 |
HOMO Energy |
-8.19 ± 0.55 eV |
LUMO Energy |
0.19 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2s)-1-[(2s)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]-n-[(1s)-2-[[(1s)-2-amino-2-oxo-1-(phenylmethyl)ethyl]amino]-1-(1h-indol-3-ylmethyl)-2-oxoethyl]-2-pyrrolidinecarboxamide
- (2s)-1-[(2s)-2-amino-3-(4-hydroxyphenyl)propanoyl]-n-[(1s)-2-[[(1s)-2-amino-2-oxo-1-(phenylmethyl)ethyl]amino]-1-(1h-indol-3-ylmethyl)-2-oxo-ethyl]pyrrolidine-2-carboxamide
- (2s)-1-[(2s)-2-amino-3-(4-hydroxyphenyl)propanoyl]-n-[(2s)-1-[[(2s)-1-amino-1-oxo-3-phenyl-propan-2-yl]amino]-3-(1h-indol-3-yl)-1-oxo-propan-2-yl]pyrrolidine-2-carboxamide
- (2s)-1-[(2s)-2-amino-3-(4-hydroxyphenyl)propanoyl]-n-[(2s)-1-[[(2s)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-3-(1h-indol-3-yl)-1-oxopropan-2-yl]pyrrolidine-2-carboxamide
- (2s)-n-[(1s)-2-[[(1s)-2-amino-1-(benzyl)-2-keto-ethyl]amino]-1-(1h-indol-3-ylmethyl)-2-keto-ethyl]-1-[(2s)-2-amino-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carboxamide
- endomorphin 1
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InChIKey |
ZEXLJFNSKAHNFH-SYKYGTKKSA-N |
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Elements |
H
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N
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