Tris-NTA

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 2
Total Number of Articles : 2
PubChem 124202503
Molecular Formula

C43H68N8O22

SMILES

C1CN(CCN(CCCN(CCN(C1)C(=O)CC[C@@H](C(=O)O)N(CC(=O)O)CC(=O)O)C(=O)CC[C@@H](C(=O)O)N(CC(=O)O)CC(=O)O)C(=O)CC[C@@H](C(=O)O)N(CC(=O)O)CC(=O)O)C(=O)CCCCCN

InChI

InChI=1S/C43H68N8O22/c44-13-3-1-2-6-31(52)45-14-4-15-47(33(54)11-8-29(42(70)71)50(24-37(60)61)25-38(62)63)20-21-48(34(55)12-9-30(43(72)73)51(26-39(64)65)27-40(66)67)17-5-16-46(19-18-45)32(53)10-7-28(41(68)69)49(22-35(56)57)23-36(58)59/h28-30H,1-27,44H2,(H,56,57)(H,58,59)(H,60,61)(H,62,63)(H,64,65)(H,66,67)(H,68,69)(H,70,71)(H,72,73)/t28-,29-,30-/m0/s1

synonyms
  • Tris-NTA
  • 862778-60-7
  • HY-D1288A
Click to show/hide the synonyms
Properties
Property Value
MW 1049.0 g/mol
HBD 10
HBA 26
Rotatable Bond Count 32
Exact Mass 1048.44481583 g/mol
Monoisotopic Mass 1048.44481583 g/mol
Heavy Atom Count 73
Isotope Atom Count 0
Atom Stereo Count 3
Covalent Unit Count 1
Complexity 1910
xlogp -12.9
Topological Polar Surface Area 453