EEB

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 6
Total Number of Articles : 3
PubChem 447113
Molecular Formula

C21H31N3O19P2

SMILES

C/C=C(\C(=O)O)/O[C@@H]1[C@H]([C@H](O[C@@H]([C@H]1O)CO)OP(=O)(O)OP(=O)(O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=CC(=O)NC3=O)O)O)NC(=O)C

InChI

InChI=1S/C21H31N3O19P2/c1-3-9(19(31)32)39-17-13(22-8(2)26)20(41-10(6-25)15(17)29)42-45(36,37)43-44(34,35)38-7-11-14(28)16(30)18(40-11)24-5-4-12(27)23-21(24)33/h3-5,10-11,13-18,20,25,28-30H,6-7H2,1-2H3,(H,22,26)(H,31,32)(H,34,35)(H,36,37)(H,23,27,33)/b9-3+/t10-,11-,13-,14-,15-,16-,17-,18-,20-/m1/s1

synonyms
  • EEB
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Properties
Property Value
MW 691.4 g/mol
HBD 9
HBA 19
Rotatable Bond Count 13
Exact Mass 691.10269976 g/mol
Monoisotopic Mass 691.10269976 g/mol
Heavy Atom Count 45
Isotope Atom Count 0
Atom Stereo Count 9
Covalent Unit Count 1
Complexity 1310
xlogp -5.4
Topological Polar Surface Area 327