Tyrosyl-Alanyl-Valyl-Threonyl-Glycyl-Arginyl-Glycyl-Aspartyl-Serine
[CAS# 115834-39-4]

Identification

• Name: Tyrosyl-Alanyl-Valyl-Threonyl-Glycyl-Arginyl-Glycyl-Aspartyl-Serine
• Synonyms: (3S)-3-[[2-[[(2S)-2-[[2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-Amino-3-(4-Hydroxyphenyl)Propanoyl]Amino]Propanoyl]Amino]-3-Methyl-Butanoyl]Amino]-3-Hydroxy-Butanoyl]Amino]Acetyl]Amino]-5-Guanidino-Pentanoyl]Amino]Acetyl]Amino]-4-[[(1S)-2-Hydroxy-1-(Hydroxymethyl)-2-Oxo-Ethyl]Amino]-4-Oxo-Butanoic Acid; (3S)-3-[[2-[[(2S)-2-[[2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-Amino-3-(4-Hydroxyphenyl)-1-Oxopropyl]Amino]-1-Oxopropyl]Amino]-3-Methyl-1-Oxobutyl]Amino]-3-Hydroxy-1-Oxobutyl]Amino]-1-Oxoethyl]Amino]-5-Guanidino-1-Oxopentyl]Amino]-1-Oxoethyl]Amino]-4-[[(1S)-2-Hydroxy-1-(Hydroxymethyl)-2-Oxoethyl]Amino]-4-Oxobutanoic Acid; (3S)-3-[[2-[[(2S)-2-[[2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-Amino-3-(4-Hydroxyphenyl)Propanoyl]Amino]Propanoyl]Amino]-3-Methyl-Butanoyl]Amino]-3-Hydroxy-Butanoyl]Amino]Acetyl]Amino]-5-Guanidino-Pentanoyl]Amino]Acetyl]Amino]-4-[[(1S)-2-Hydroxy-2-Keto-1-Methylol-Ethyl]Amino]-4-Keto-Butyric Acid
• Molecular Formula: C₃₈H₆₀N₁₂O₁₅
• Molecular Weight: 924.96
• CAS Registry Number: 115834-39-4
• SMILES: [C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C)(C(C)C)C(=O)N[C@@H]([C@H](O)C)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(O)=O
• InChI: 1S/C38H60N12O15/c1-17(2)29(49-31(58)18(3)45-32(59)22(39)12-20-7-9-21(53)10-8-20)36(63)50-30(19(4)52)35(62)44-15-26(54)46-23(6-5-11-42-38(40)41)33(60)43-14-27(55)47-24(13-28(56)57)34(61)48-25(16-51)37(64)65/h7-10,17-19,22-25,29-30,51-53H,5-6,11-16,39H2,1-4H3,(H,43,60)(H,44,62)(H,45,59)(H,46,54)(H,47,55)(H,48,61)(H,49,58)(H,50,63)(H,56,57)(H,64,65)(H4,40,41,42)/t18-,19+,22-,23-,24-,25-,29-,30-/m0/s1
• InChIKey: HGUIGIFJDSEBMS-YZUVYHPZSA-N

Properties

• Density: 1.538g/cm³ (Cal.)