Neurotensin-related hexapeptide
Basic information
- CAS
85213-84-9- Standard SMILES
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O- InChIKey
VKJAQCBNNAUEKB-YYNHRMGXSA-N- Molecular formula
- C36H58N8O9
- Average molar mass
- 746.9 g/mol
- Monoisotopic mass
- 746.43267546
Overview
from chicken intestine
Names & identifiers
- Preferred name
- Neurotensin-related hexapeptide
- IUPAC
- (2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-1-[(2S)-4-amino-2-[[(2S)-2,6-diaminohexanoyl]amino]-4-oxobutanoyl]pyrrolidine-2-carbonyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylpentanoyl]amino]-4-methylpentanoic acid
- English name
- neurotensin-related hexapeptide
- Molecular formula
- C36H58N8O9
- Molecular weight
- 746.89
Names & synonyms
85213-84-9Lant-6H-Lys-asn-pro-tyr-ile-leu-OH8-Lys-9-asn-neurotensin (8-13)Lysyl-asparaginyl-prolyl-tyrosyl-isoleucyl-leucinolNeurotensin (8-13), lys(8)-asn(9)-Neurotensin (8-13), lysyl(8)-asparaginine(9)-L-Leucine, N-(N-(N-(1-(N2-L-lysyl-L-asparaginyl)-L-prolyl)-L-tyrosyl)-L-isoleucyl)-RefChem:165597(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-1-[(2S)-4-amino-2-[[(2S)-2,6-diaminohexanoyl]amino]-4-oxobutanoyl]pyrrolidine-2-carbonyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylpentanoyl]amino]-4-methylpentanoic acidorb1983703DTXSID001005683
Show more names
neurotensin-related hexapeptideL-Leucine, L-lysyl-L-asparaginyl-L-prolyl-L-tyrosyl-L-isoleucyl-
TP2393N-(2-{[2-{[{1-[N-(2,6-Diamino-1-hydroxyhexylidene)-4-iminohomoseryl]pyrrolidin-2-yl}(hydroxy)methylidene]amino}-1-hydroxy-3-(4-hydroxyphenyl)propylidene]amino}-1-hydroxy-3-methylpentylidene)leucineN-[(2S,3S)-2-{[(2S)-2-({[(2S)-1-{N-[(2S)-2,6-Diamino-1-hydroxyhexylidene]-4-imino-L-homoseryl}pyrrolidin-2-yl](hydroxy)methylidene}amino)-1-hydroxy-3-(4-hydroxyphenyl)propylidene]amino}-1-hydroxy-3-methylpentylidene]-L-leucine
Properties
Computed structural properties
- XLogP
- -1.8
- Topological polar surface area
- 289 Ų
- Hydrogen bond donors
- 9
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 22
- Heavy atoms
- 53
- Formal charge
- 0
- Complexity
- 1,260
Physicochemical properties
- Boiling point
- 1162.9 · 1162.9±65.0 °C(Predicted)
- Density
- 1.251 · 1.251±0.06 g/cm3(Predicted)
- pka
- 3.41 · 3.41±0.10(Predicted)
Chemistry & industry
Applications
DescriptionNeurotensin-related hexapeptide is found in retinal ganglion cells and in their central projections in pigeons. Neurotensin-related hexapeptide may be utilized as a neuroactive substance by the central terminals of numerous retinal ganglion cells in birds.
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Compound notes
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