copper(2+) bis(acetic acid) bis(6-amino-2-[2-(2-aminoacetamido)-3-(1H-imidazol-4-yl)propanamido]hexanoate)

CAS: 130120-57-9

Formula: C32H54CuN12O12

SMILES: [Cu++].CC(O)=O.CC(O)=O.NCCCCC(NC(=O)C(CC1=CNC=N1)NC(=O)CN)C([O-])=O.NCCCCC(NC(=O)C(CC1=CNC=N1)NC(=O)CN)C([O-])=O

IUPAC: copper(2+) bis(acetic acid) bis(6-amino-2-[2-(2-aminoacetamido)-3-(1H-imidazol-4-yl)propanamido]hexanoate)

InChI: InChI=1/2C14H24N6O4.2C2H4O2.Cu/c2*15-4-2-1-3-10(14(23)24)20-13(22)11(19-12(21)6-16)5-9-7-17-8-18-9;2*1-2(3)4;/h2*7-8,10-11H,1-6,15-16H2,(H,17,18)(H,19,21)(H,20,22)(H,23,24);2*1H3,(H,3,4);/q;;;;+2/p-2

Composition: C (44.57%), H (6.31%), Cu (7.37%), N (19.49%), O (22.26%)

Molar Mass: 862.402

Atom Count: 111

Heavy Atom Count: 57