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57468-17-4

57468-17-4 structural image
Product Name: SUBSTANCE P (1-9)
Formula: C52H77N15O12
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COMPUTED DESCRIPTORS

Molecular Weight 1104.3 g/mol
XLogP3 -5.4
Hydrogen Bond Donor Count 13
Hydrogen Bond Acceptor Count 15
Rotatable Bond Count 33
Exact Mass 1103.58761295 g/mol
Monoisotopic Mass 1103.58761295 g/mol
Topological Polar Surface Area 455 Ų
Heavy Atom Count 79
Formal Charge 0
Complexity 2130
Isotope Atom Count 0
Defined Atom Stereocenter Count 8
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes