murabutide

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 38
Total Number of Articles : 29
PubChem 92043535
Molecular Formula

C23H40N4O11

SMILES

CCCCOC(=O)C(CCC(=O)N)NC(=O)C(C)NC(=O)C(C)O[C@@H]1[C@H]([C@@H](O[C@@H]([C@H]1O)CO)O)NC(=O)C

InChI

InChI=1S/C23H40N4O11/c1-5-6-9-36-22(34)14(7-8-16(24)30)27-20(32)11(2)25-21(33)12(3)37-19-17(26-13(4)29)23(35)38-15(10-28)18(19)31/h11-12,14-15,17-19,23,28,31,35H,5-10H2,1-4H3,(H2,24,30)(H,25,33)(H,26,29)(H,27,32)/t11?,12?,14?,15-,17-,18-,19-,23-/m1/s1

synonyms
  • MURABUTIDE
  • 74817-61-1
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Properties
Property Value
MW 548.6 g/mol
HBD 7
HBA 11
Rotatable Bond Count 16
Exact Mass 548.26935810 g/mol
Monoisotopic Mass 548.26935810 g/mol
Heavy Atom Count 38
Isotope Atom Count 0
Atom Stereo Count 8
Covalent Unit Count 1
Complexity 827
xlogp -2.1
Topological Polar Surface Area 236