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141595-53-1 | D-Tryptophan, N-[(hexahydro-1H-azepin-1-yl)carbonyl]-L-leucyl-1-formyl-D-tryptophyl-
CAS No: 141595-53-1 Catalog No: AG001GNK MDL No:
Product Description
Catalog Number:
AG001GNK
Chemical Name:
D-Tryptophan, N-[(hexahydro-1H-azepin-1-yl)carbonyl]-L-leucyl-1-formyl-D-tryptophyl-
CAS Number:
141595-53-1
Molecular Formula:
C36H44N6O6
Molecular Weight:
656.7712
IUPAC Name:
(2R)-2-[[(2R)-2-[[(2S)-2-(azepane-1-carbonylamino)-4-methylpentanoyl]amino]-3-(1-formylindol-3-yl)propanoyl]amino]-3-(1H-indol-3-yl)propanoic acid
InChI:
InChI=1S/C36H44N6O6/c1-23(2)17-29(40-36(48)41-15-9-3-4-10-16-41)33(44)38-30(19-25-21-42(22-43)32-14-8-6-12-27(25)32)34(45)39-31(35(46)47)18-24-20-37-28-13-7-5-11-26(24)28/h5-8,11-14,20-23,29-31,37H,3-4,9-10,15-19H2,1-2H3,(H,38,44)(H,39,45)(H,40,48)(H,46,47)/t29-,30+,31+/m0/s1
InChI Key:
QHSRPPJQBFQWSC-OJDZSJEKSA-N
SMILES:
O=Cn1cc(c2c1cccc2)C[C@H](C(=O)N[C@@H](C(=O)O)Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)N1CCCCCC1)CC(C)C
Properties
Complexity:
1130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
656.332g/mol
Formal Charge:
0
Heavy Atom Count:
48
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
656.784g/mol
Monoisotopic Mass:
656.332g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
166A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
Literature
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|---|---|
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| Endothelin-1-dependent leptin induction in gastric mucosal inflammatory responses to Helicobacter pylori lipopolysaccharide. | Biochemical and biophysical research communications 20051104 |
| Endothelin-1 causes systemic vasodilatation in anaesthetised turtles (Trachemys scripta) through activation of ETB-receptors. | The Journal of experimental biology 20051001 |
| Involvement of nitric oxide pathways in short term modulation of tyrosine hydroxylase activity by endothelins 1 and 3 in the rat anterior hypothalamus. | Biochemical and biophysical research communications 20050902 |
| Endothelin-3 applied to the brain evokes opposite effects on bile secretion mediated by a central nitric oxide pathway. | Peptides 20050701 |
| Endothelin-1 induces lipolysis in 3T3-L1 adipocytes. | American journal of physiology. Endocrinology and metabolism 20050601 |
| Vascular reactivity of mesenteric arteries and veins to endothelin-1 in a murine model of high blood pressure. | Vascular pharmacology 20050601 |
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| Prior antagonism of endothelin-1A receptors alleviates circulatory shock and cerebral ischemia during rat heatstroke. | Journal of pharmacological sciences 20041001 |
| Porphyromonas gingivalis lipopolysaccharide-induced up-regulation in endothelin-1 interferes with salivary mucin synthesis via epidermal growth factor receptor transactivation. | IUBMB life 20041001 |
| Endothelin 1 and 3 enhance neuronal nitric oxide synthase activity through ETB receptors involving multiple signaling pathways in the rat anterior hypothalamus. | Peptides 20040701 |
| Increased O2*- production and upregulation of ETB receptors by sympathetic neurons in DOCA-salt hypertensive rats. | Hypertension (Dallas, Tex. : 1979) 20040501 |
| Modulatory effect of endothelin-1 and -3 on neuronal norepinephrine release in the rat posterior hypothalamus. | Regulatory peptides 20040415 |
| Alteration in endothelin receptor sub-type responsiveness and in the endothelin-TXA(2) mimetic U46619 interaction, in type-2 hypertensive diabetic Zucker rats. | Diabetes research and clinical practice 20040301 |
| Alterations of renal hemodynamics in unilateral ureteral obstruction mediated by activation of endothelin receptor subtypes. | The Journal of urology 20031101 |
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| Cyclooxygenase is regulated by ET-1 and MAPKs in peripheral lung microvascular smooth muscle cells. | American journal of physiology. Lung cellular and molecular physiology 20030401 |
| Endothelin inhibits NPR-A and stimulates eNOS gene expression in rat IMCD cells. | Hypertension (Dallas, Tex. : 1979) 20030301 |
| Effects of catechins on vascular tone in rat thoracic aorta with endothelium. | Life sciences 20021011 |
| Mechanism of RhoA/Rho kinase activation in endothelin-1- induced contraction in rabbit basilar artery. | American journal of physiology. Heart and circulatory physiology 20020901 |
| Endothelin-1 and -3 diminish neuronal NE release through an NO mechanism in rat anterior hypothalamus. | American journal of physiology. Regulatory, integrative and comparative physiology 20020901 |
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| Endothelin receptor function in mesenteric veins from deoxycorticosterone acetate salt-hypertensive rats. | Journal of hypertension 20020401 |
| Endothelin resets renal blood flow autoregulatory efficiency during acute blockade of NO in the rat. | American journal of physiology. Renal physiology 20011201 |
| Adrenergic and endothelin B receptor-dependent hypertension in dopamine receptor type-2 knockout mice. | Hypertension (Dallas, Tex. : 1979) 20010901 |
| Chronic endothelin-1 treatment leads to heterologous desensitization of insulin signaling in 3T3-L1 adipocytes. | The Journal of clinical investigation 20010501 |
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| [3H]BQ-123, a highly specific and reversible radioligand for the endothelin ETA receptor subtype. | European journal of pharmacology 19950214 |
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