L-Glutaminyl-L-Arginyl-L-Prolyl-L-Arginyl-L-Leucyl-L-Seryl-L-Histidyl-L-Lysylglycyl-L-Prolyl-L-Methionylprolyl-L-Phenylalanine
[CAS# 217082-58-1]

Identification

• Classification: Biochemical >> Peptide
• Name: L-Glutaminyl-L-Arginyl-L-Prolyl-L-Arginyl-L-Leucyl-L-Seryl-L-Histidyl-L-Lysylglycyl-L-Prolyl-L-Methionylprolyl-L-Phenylalanine
• Synonyms: Apelin-13; L-glutaminyl-L-arginyl-L-prolyl-L-arginyl-L-leucyl-L-seryl-L-histidyl-L-lysylglycyl-L-prolyl-L-methionyl-L-prolyl-L-phenylalanine; L-Glutaminyl-L-arginyl-L-prolyl-L-arginyl-L-leucyl-L-seryl-L-histidyl-L-lysylglycyl-L-prolyl-L-methionylprolyl-L-phenylalanin
• Molecular Formula: C₆₉H₁₁₁N₂₃O₁₆S
• Molecular Weight: 1550.83
• CAS Registry Number: 217082-58-1
• SMILES: CC(C)C[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N2CCC[C@H]2C(=O)N[C@@H](CCSC)C(=O)N3CCCC3C(=O)N[C@@H](Cc4ccccc4)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]5CCCN5C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N)N
• InChI: 1S/C69H111N23O16S/c1-39(2)32-47(86-58(98)44(17-9-26-78-68(73)74)83-63(103)52-20-12-29-91(52)65(105)45(18-10-27-79-69(75)76)84-56(96)42(71)22-23-54(72)94)59(99)89-50(37-93)61(101)87-48(34-41-35-77-38-81-41)60(100)82-43(16-7-8-25-70)57(97)80-36-55(95)90-28-11-19-51(90)62(102)85-46(24-31-109-3)66(106)92-30-13-21-53(92)64(104)88-49(67(107)108)33-40-14-5-4-6-15-40/h4-6,14-15,35,38-39,42-53,93H,7-13,16-34,36-37,70-71H2,1-3H3,(H2,72,94)(H,77,81)(H,80,97)(H,82,100)(H,83,103)(H,84,96)(H,85,102)(H,86,98)(H,87,101)(H,88,104)(H,89,99)(H,107,108)(H4,73,74,78)(H4,75,76,79)/t42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53?/m0/s1
• InChIKey: XXCCRHIAIBQDPX-HYAIPSJSSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Refractive index: 1.688 (Cal.)