Cilastatin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 40
Total Number of Articles : 59
PubChem 6435415
Molecular Formula

C16H26N2O5S

SMILES

CC1(C[C@@H]1C(=O)N/C(=C\CCCCSC[C@@H](C(=O)O)N)/C(=O)O)C

InChI

InChI=1S/C16H26N2O5S/c1-16(2)8-10(16)13(19)18-12(15(22)23)6-4-3-5-7-24-9-11(17)14(20)21/h6,10-11H,3-5,7-9,17H2,1-2H3,(H,18,19)(H,20,21)(H,22,23)/b12-6-/t10-,11+/m1/s1

synonyms
  • Cilastatin
  • 82009-34-5
  • Cilastatina
Click to show/hide the synonyms
Properties
Property Value
MW 358.5 g/mol
HBD 4
HBA 7
Rotatable Bond Count 11
Exact Mass 358.15624311 g/mol
Monoisotopic Mass 358.15624311 g/mol
Heavy Atom Count 24
Isotope Atom Count 0
Atom Stereo Count 2
Covalent Unit Count 1
Complexity 519
xlogp -1
Topological Polar Surface Area 155