Pasireotide L-aspartate salt
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Pasireotide L-aspartate salt

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Pasireotide is a synthetic long-acting cyclic hexapeptide exhibits unique high-affinity binding to human somatostatin receptors.

Category
Peptide Inhibitors
Catalog number
BAT-010799
CAS number
396091-77-3
Molecular Formula
C62H73N11O13
Molecular Weight
1180.31
Pasireotide L-aspartate salt
IUPAC Name
(2S)-2-aminobutanedioic acid;[9-(4-aminobutyl)-3-benzyl-12-(1H-indol-3-ylmethyl)-2,5,8,11,14,17-hexaoxo-15-phenyl-6-[(4-phenylmethoxyphenyl)methyl]-1,4,7,10,13,16-hexazabicyclo[16.3.0]henicosan-20-yl] N-(2-aminoethyl)carbamate
Synonyms
cyclo((4R)-4-(2-Aminoethylcarbamoyloxy)-L-prolyl-L-phenylglycyl-D-tryptophyl-L-lysyl-4-O-benzyl-L-tyrosyl-L- phenylalanyl-) L-aspartate salt
Related CAS
396091-73-9 820232-50-6 (diaspartate)
Appearance
Solid powder
Purity
≥98%
Sequence
H-Asp-OH.cyclo[DL-Lys-DL-Tyr(Bn)-DL-Phe-DL-xiHyp(Unk)-DL-Phg-DL-Trp]
Storage
Store at -20 °C
Solubility
Soluble in DMSO
InChI
1S/C58H66N10O9/c59-27-13-12-22-46-52(69)64-47(30-38-23-25-42(26-24-38)76-36-39-16-6-2-7-17-39)53(70)66-49(31-37-14-4-1-5-15-37)57(74)68-35-43(77-58(75)61-29-28-60)33-50(68)55(72)67-51(40-18-8-3-9-19-40)56(73)65-48(54(71)63-46)32-41-34-62-45-21-11-10-20-44
InChI Key
NEEFMPSSNFRRNC-HQUONIRXSA-N
Canonical SMILES
C1C(CN2C1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C2=O)CC3=CC=CC=C3)CC4=CC=C(C=C4)OCC5=CC=CC=C5)CCCCN)CC6=CNC7=CC=CC=C76)C8=CC=CC=C8)OC(=O)NCCN.C(C(C(=O)O)N)C(=O)O
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