N(1)Trp-His-Gly-Thr-Ala-Pro-Asp(2)-Trp-Phe-Phe-Asn-Tyr-Tyr-Trp-OH.N(2)Gly-DL-Asp(1)-NH2

Base Information

• Chemical Name: N(1)Trp-His-Gly-Thr-Ala-Pro-Asp(2)-Trp-Phe-Phe-Asn-Tyr-Tyr-Trp-OH.N(2)Gly-DL-Asp(1)-NH2
• CAS No.: 151308-34-8
• Molecular Formula: C103H115 N23 O23
• Molecular Weight: 2043.16
• Mol file: 151308-34-8.mol

Synonyms:RES 701-1;RES-701-1

Chemical Property of N(1)Trp-His-Gly-Thr-Ala-Pro-Asp(2)-Trp-Phe-Phe-Asn-Tyr-Tyr-Trp-OH.N(2)Gly-DL-Asp(1)-NH2

Chemical Property:

• PKA: 3.35±0.10(Predicted)
• PSA: 717.03000
• Density: 1.50±0.1 g/cm3(Predicted)
• LogP: 4.37700
• Storage Temp.: −20°C
• XLogP3: 2
• Hydrogen Bond Donor Count: 25
• Hydrogen Bond Acceptor Count: 24
• Rotatable Bond Count: 35
• Exact Mass: 2042.85697184
• Heavy Atom Count: 149
• Complexity: 4650

Purity/Quality:

99% ^*data from raw suppliers

Cyclo(-Gly-Asn-Trp-His-Gly-Thr-Ala-Pro-Asp)-Trp-Phe-Phe-Asn-Tyr-Tyr-Trp-OH ^*data from reagent suppliers

Safty Information:

• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(=O)N2CCCC2C(=O)NC(CC(=O)NCC(=O)NC(CC(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)N1)C(C)O)CC3=CN=CN3)CC4=CNC5=CC=CC=C54)C(=O)N)C(=O)NC(CC6=CNC7=CC=CC=C76)C(=O)NC(CC8=CC=CC=C8)C(=O)NC(CC9=CC=CC=C9)C(=O)NC(CC(=O)N)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O
• Isomeric SMILES: C[C@H]1C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(=O)NCC(=O)NC(CC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N1)[C@@H](C)O)CC3=CN=CN3)CC4=CNC5=CC=CC=C54)C(=O)N)C(=O)N[C@@H](CC6=CNC7=CC=CC=C76)C(=O)N[C@@H](CC8=CC=CC=C8)C(=O)N[C@@H](CC9=CC=CC=C9)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O