cholecystokinin C-terminal flanking peptide

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 433
Total Number of Articles : 377
PubChem 130508
Molecular Formula

C46H61N9O26S2

SMILES

C[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC1=CC=C(C=C1)OS(=O)(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC2=CC=C(C=C2)OS(=O)(=O)O)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CO)N

InChI

InChI=1S/C46H61N9O26S2/c1-22(48-39(65)27(47)20-56)38(64)49-28(12-14-35(58)59)40(66)52-31(19-37(62)63)43(69)51-30(17-23-4-8-25(9-5-23)80-82(74,75)76)42(68)50-29(13-15-36(60)61)41(67)53-32(18-24-6-10-26(11-7-24)81-83(77,78)79)45(71)55-16-2-3-34(55)44(70)54-33(21-57)46(72)73/h4-11,22,27-34,56-57H,2-3,12-21,47H2,1H3,(H,48,65)(H,49,64)(H,50,68)(H,51,69)(H,52,66)(H,53,67)(H,54,70)(H,58,59)(H,60,61)(H,62,63)(H,72,73)(H,74,75,76)(H,77,78,79)/t22-,27-,28-,29-,30-,31-,32-,33-,34-/m0/s1

synonyms
  • Cholecystokinin C-terminal flanking peptide
  • 101162-62-3
  • Cck-tfp
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Properties
Property Value
MW 1220.2 g/mol
HBD 16
HBA 27
Rotatable Bond Count 34
Exact Mass 1219.31691543 g/mol
Monoisotopic Mass 1219.31691543 g/mol
Heavy Atom Count 83
Isotope Atom Count 0
Atom Stereo Count 9
Covalent Unit Count 1
Complexity 2570
xlogp -7.4
Topological Polar Surface Area 584