Deltorphin C
[CAS# 122752-15-2]

Identification

• Name: Deltorphin C
• Synonyms: (3S)-3-[[(2S)-2-[[(2R)-2-[[(2S)-2-Amino-3-(4-Hydroxyphenyl)Propanoyl]Amino]Propanoyl]Amino]-3-Phenyl-Propanoyl]Amino]-4-[[1-[[(1S)-1-[(2-Amino-2-Oxo-Ethyl)Carbamoyl]-2-Methyl-Propyl]Carbamoyl]-2-Methyl-Propyl]Amino]-4-Oxo-Butanoic Acid; (3S)-3-[[(2S)-2-[[(2R)-2-[[(2S)-2-Amino-3-(4-Hydroxyphenyl)-1-Oxopropyl]Amino]-1-Oxopropyl]Amino]-1-Oxo-3-Phenylpropyl]Amino]-4-[[1-[[[(1S)-1-[[(2-Amino-2-Oxoethyl)Amino]-Oxomethyl]-2-Methylpropyl]Amino]-Oxomethyl]-2-Methylpropyl]Amino]-4-Oxobutanoic Acid; (3S)-3-[[(2S)-2-[[(2R)-2-[[(2S)-2-Amino-3-(4-Hydroxyphenyl)Propanoyl]Amino]Propanoyl]Amino]-3-Phenyl-Propanoyl]Amino]-4-[[1-[[(1S)-1-[(2-Amino-2-Keto-Ethyl)Carbamoyl]-2-Methyl-Propyl]Carbamoyl]-2-Methyl-Propyl]Amino]-4-Keto-Butyric Acid
• Molecular Formula: C₃₇H₅₂N₈O₁₀
• Molecular Weight: 768.87
• CAS Registry Number: 122752-15-2
• SMILES: [C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C)CC2=CC=CC=C2)(C(=O)NC(C(=O)N[C@H](C(=O)NCC(=O)N)C(C)C)C(C)C)CC(=O)O
• InChI: 1S/C37H52N8O10/c1-19(2)30(36(54)40-18-28(39)47)45-37(55)31(20(3)4)44-35(53)27(17-29(48)49)43-34(52)26(16-22-9-7-6-8-10-22)42-32(50)21(5)41-33(51)25(38)15-23-11-13-24(46)14-12-23/h6-14,19-21,25-27,30-31,46H,15-18,38H2,1-5H3,(H2,39,47)(H,40,54)(H,41,51)(H,42,50)(H,43,52)(H,44,53)(H,45,55)(H,48,49)/t21-,25+,26+,27+,30+,31?/m1/s1
• InChIKey: CJAORFIPPWIGPG-OBUNQCGMSA-N

Properties

• Desity: 1.284g/cm³ (Cal.)
• Boiling point: 1242.366°C at 760 mmHg (Cal.)
• Flash point: 705.157°C (Cal.)