PYR-GLY-LEU-PRO-PRO-GLY-PRO-PRO-ILE-PRO-PRO 30953-20-9 wiki

1.2 Synonyms: 5-Oxo-L-prolylglycyl-L-leucyl-L-prolyl-D-prolylglycyl-D-prolyl-L-prolyl-L-isoleucyl-D-prolyl-L-proline; Bradykinin potentiator c; Bradykinin Potentiator C Pyr-Gly-Leu-Pro-Pro-Gly-Pro-Pro-Ile-Pro-Pro-OH; L-Proline, 5-oxo-L-prolylglycyl-L-leucyl-L-prolyl-D-prolylglycyl-D-prolyl-L-prolyl-L-isoleucyl-D-prolyl-; MFCD00076286; PGLU-GLY-LEU-PRO-PRO-GLY-PRO-PRO-ILE-PRO-PRO; potentiator C; PYR-GLPPGPPIPP; PYR-GLY-LEU-PRO-PRO-GLY-PRO-PRO-ILE-PRO-PRO-OH; PYROGLU-GLY-LEU-PRO-PRO-GLY-PRO-PRO-ILE-PRO-PRO; radykinin Potentiator C: Angiotensin I Converting Enzyme Inhibitor;

1.6 Inchi: InChI=1S/C51H77N11O13/c1-5-30(4)42(50(73)61-24-10-16-37(61)49(72)62-25-11-17-38(62)51(74)75)56-45(68)34-13-7-22-59(34)47(70)35-14-8-20-57(35)41(65)28-53-44(67)33-12-6-21-58(33)48(71)36-15-9-23-60(36)46(69)32(26-29(2)3)55-40(64)27-52-43(66)31-18-19-39(63)54-31/h29-38,42H,5-28H2,1-4H3,(H,52,66)(H,53,67)(H,54,63)(H,55,64)(H,56,68)(H,74,75)

1.8 Canonical Smiles: CCC(C)C(C(=O)N1CCCC1C(=O)N2CCCC2C(=O)O)NC(=O)C3CCCN3C(=O)C4CCCN4C(=O)CNC(=O)C5CCCN5C(=O)C6CCCN6C(=O)C(CC(C)C)NC(=O)CNC(=O)C7CCC(=O)N7

1.9 Isomers Smiles: CCC(C)C(C(=O)N1CCCC1C(=O)N2CCCC2C(=O)O)NC(=O)C3CCCN3C(=O)C4CCCN4C(=O)CNC(=O)C5CCCN5C(=O)C6CCCN6C(=O)C(CC(C)C)NC(=O)CNC(=O)C7CCC(=O)N7

no data available

no data available

Molecular Weight： 1052.23g/mol
Molecular Formula：C₅₁H₇₇N₁₁O₁₃
Compound Is Canonicalized：True
Exact Mass：0.4
XLogP3-AA：1051.57023155
Monoisotopic Mass：1051.57023155
Complexity：2250
Rotatable Bond Count：19
Hydrogen Bond Donor Count：6
Hydrogen Bond Acceptor Count：13
Topological Polar Surface Area：305
Heavy Atom Count：：75
Defined Atom Stereocenter Count：0
Undefined Atom Stereocenter Count：10
Defined Bond Stereocenter Count：0
Undefined Bond Stereocenter Count：0
Isotope Atom Count：0
Covalently-Bonded Unit Count：1
CACTVS Substructure Key Fingerprint：AAADcfB//AAAAAAAAAAAAAAAAAAAAWLFixYAAAAAAAAAAAAAAAAAHgAQCAAADSjBgAQCCAPAAgAIAAGQGAAAAAAAAAAAAIGIAAACQBIAgCAUQAAEFgCQAACcEwIOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==