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1029890-89-8

1029890-89-8 structural image
Product Name: 1-[(4R,5R)-4,5-Dihydroxy-L-ornithine]echinocandin B hydrochloride (1:1)
Formula: C34H52ClN7O15
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COMPUTED DESCRIPTORS

Molecular Weight 834.3 g/mol
Hydrogen Bond Donor Count 15
Hydrogen Bond Acceptor Count 16
Rotatable Bond Count 5
Exact Mass 833.3209917 g/mol
Monoisotopic Mass 833.3209917 g/mol
Topological Polar Surface Area 365 Ų
Heavy Atom Count 57
Formal Charge 0
Complexity 1450
Isotope Atom Count 0
Defined Atom Stereocenter Count 15
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes