D-Arginyl-D-Prolyl-L-Arginyl-L-Leucyl-D-Seryl-L-Histidyl-D-Lysylglycyl-L-Prolyl-D-Methionyl-L-Prolyl-D-Phenylalanine
[CAS# 229961-08-4]

Identification

• Name: D-Arginyl-D-Prolyl-L-Arginyl-L-Leucyl-D-Seryl-L-Histidyl-D-Lysylglycyl-L-Prolyl-D-Methionyl-L-Prolyl-D-Phenylalanine
• Synonyms: Apelin 12 (human, bovine, mouse, rat); D-Arginyl-D-prolyl-L-arginyl-L-leucyl-D-seryl-L-histidyl-D-lysylglycyl-L-prolyl-D-methionyl-L-prolyl-D-phenylalanin; D-Arginyl-D-prolyl-L-arginyl-L-leucyl-D-seryl-L-histidyl-D-lysylglycyl-L-prolyl-D-methionyl-L-prolyl-D-phenylalanine
• Molecular Formula: C₆₄H₁₀₃N₂₁O₁₄S
• Molecular Weight: 1422.70
• CAS Registry Number: 229961-08-4
• SMILES: CC(C)C[C@@H](C(=O)N[C@H](CO)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](CCCCN)C(=O)NCC(=O)N2CCC[C@H]2C(=O)N[C@H](CCSC)C(=O)N3CCC[C@H]3C(=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)N
• InChI: 1S/C64H103N21O14S/c1-37(2)30-44(79-53(89)42(18-10-25-73-64(69)70)77-58(94)49-20-12-27-84(49)60(96)40(66)16-9-24-72-63(67)68)54(90)82-47(35-86)56(92)80-45(32-39-33-71-36-75-39)55(91)76-41(17-7-8-23-65)52(88)74-34-51(87)83-26-11-19-48(83)57(93)78-43(22-29-100-3)61(97)85-28-13-21-50(85)59(95)81-46(62(98)99)31-38-14-5-4-6-15-38/h4-6,14-15,33,36-37,40-50,86H,7-13,16-32,34-35,65-66H2,1-3H3,(H,71,75)(H,74,88)(H,76,91)(H,77,94)(H,78,93)(H,79,89)(H,80,92)(H,81,95)(H,82,90)(H,98,99)(H4,67,68,72)(H4,69,70,73)/t40-,41-,42+,43-,44+,45+,46-,47-,48+,49-,50+/m1/s1
• InChIKey: KIODTAJAFBDDGP-DGDQILBASA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Refractive index: 1.686 (Cal.)