Prezatide copper acetate

• Catalog Number: ACM130120579-2
• Product Name: Prezatide copper acetate
• CAS: 130120-57-9
• Category: Heterocyclic Organic Compound
• Synonyms: Lamin; PC 1020 acetate
• IUPAC Name: copper; acetic acid; 6-amino-2-[[2-[(2-aminoacetyl)amino]-3-(1H-imidazol-5-yl)propanoyl]amino]hexanoate; 6-amino-2-[[2-[(2-amino-1-oxidoethylidene)amino]-3-(1H-imidazol-5-yl)propanoyl]amino]hexanoate; hydron
• Molecular Weight: 862.4
• Molecular Formula: C32H54CuN12O12
• Canonical SMILES: CC(=O)O.CC(=O)O.C1=C(NC=N1)CC(C(=O)NC(CCCCN)C(=O)[O-])NC(=O)CN.C1=C(NC=N1)CC(C(=O)NC(CCCCN)C(=O)[O-])NC(=O)CN.[Cu+2]
• InChI: InChI=1S/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
• InChI Key: LUNQZVCDZKODKF-UHFFFAOYSA-L
• Boiling Point: 831ºC at 760mmHg
• Flash Point: 456.4ºC
• Density: g/cm³
• Complexity: 459
• Covalently-Bonded Unit Count: 5
• Defined Atom Stereocenter Count: 0
• Exact Mass: 861.328012
• H-Bond Acceptor: 19
• H-Bond Donor: 11
• Heavy Atom Count: 57
• Hydrogen Bond Acceptor Count: 18
• Hydrogen Bond Donor Count: 12
• Monoisotopic Mass: 861.328012
• Rotatable Bond Count: 20
• Topological Polar Surface Area: 433 Ų