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121869-35-0

121869-35-0 structural image
Product Name: 9-(2,5-d|Dioxo-L-3-aMino-1-pyrrolidineacetic acid)-10-deglycine DaptoMycin
Formula: C72H99N17O25
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COMPUTED DESCRIPTORS

Molecular Weight 1602.7 g/mol
XLogP3 -4.9
Hydrogen Bond Donor Count 20
Hydrogen Bond Acceptor Count 27
Rotatable Bond Count 33
Exact Mass 1601.69980171 g/mol
Monoisotopic Mass 1601.69980171 g/mol
Topological Polar Surface Area 673 Ų
Heavy Atom Count 114
Formal Charge 0
Complexity 3510
Isotope Atom Count 0
Defined Atom Stereocenter Count 13
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes