Alanyl(2)-N-(2-(Dimethylamino)Ethyl)-N(alpha)-Methyl-Phenylalaninamide(4)-Enkephalin
[CAS# 75638-63-0]

Identification

• Name: Alanyl(2)-N-(2-(Dimethylamino)Ethyl)-N(alpha)-Methyl-Phenylalaninamide(4)-Enkephalin
• Synonyms: (2S)-2-[[2-[[(2R)-2-[[(2S)-2-Amino-3-(4-Hydroxyphenyl)Propanoyl]Amino]Propanoyl]Amino]Acetyl]-Methyl-Amino]-N-(2-Dimethylaminoethyl)-3-Phenyl-Propanamide; (2S)-2-[[2-[[(2R)-2-[[(2S)-2-Amino-3-(4-Hydroxyphenyl)-1-Oxopropyl]Amino]-1-Oxopropyl]Amino]-1-Oxoethyl]-Methylamino]-N-(2-Dimethylaminoethyl)-3-Phenylpropanamide; (2S)-2-[[2-[[(2R)-2-[[(2S)-2-Amino-3-(4-Hydroxyphenyl)Propanoyl]Amino]Propanoyl]Amino]Acetyl]-Methyl-Amino]-N-(2-Dimethylaminoethyl)-3-Phenyl-Propionamide
• Molecular Formula: C₂₈H₄₀N₆O₅
• Molecular Weight: 540.66
• CAS Registry Number: 75638-63-0
• SMILES: [C@@H](N(C(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C)C)(C(=O)NCCN(C)C)CC2=CC=CC=C2
• InChI: 1S/C28H40N6O5/c1-19(32-27(38)23(29)16-21-10-12-22(35)13-11-21)26(37)31-18-25(36)34(4)24(17-20-8-6-5-7-9-20)28(39)30-14-15-33(2)3/h5-13,19,23-24,35H,14-18,29H2,1-4H3,(H,30,39)(H,31,37)(H,32,38)/t19-,23+,24+/m1/s1
• InChIKey: KRWUPJRFKUZPCP-YGOYIFOWSA-N

Properties

• Density: 1.21g/cm³ (Cal.)
• Boiling point: 882.319°C at 760 mmHg (Cal.)
• Flash point: 487.409°C (Cal.)