bactobolin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 2
Total Number of Articles : 3
PubChem 54676871
Molecular Formula

C14H20Cl2N2O6

SMILES

C[C@@H](C(=O)N[C@@H]1[C@@H]2[C@H]([C@@H](CC(=C2C(=O)O[C@]1(C)C(Cl)Cl)O)O)O)N

InChI

InChI=1S/C14H20Cl2N2O6/c1-4(17)11(22)18-10-8-7(5(19)3-6(20)9(8)21)12(23)24-14(10,2)13(15)16/h4,6,8-10,13,19-21H,3,17H2,1-2H3,(H,18,22)/t4-,6+,8-,9-,10+,14-/m0/s1

synonyms
  • Bactobolin
  • (-)-Bactobolin
  • 72615-20-4
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Properties
Property Value
MW 383.2 g/mol
HBD 5
HBA 7
Rotatable Bond Count 3
Exact Mass 382.0698418 g/mol
Monoisotopic Mass 382.0698418 g/mol
Heavy Atom Count 24
Isotope Atom Count 0
Atom Stereo Count 6
Covalent Unit Count 1
Complexity 584
xlogp -0.3
Topological Polar Surface Area 142