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1476-46-6

1476-46-6 structural image
Product Name: deacetylcephalosporin C
Formula: C14H19N3O7S
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COMPUTED DESCRIPTORS

Molecular Weight 373.38 g/mol
XLogP3 -5
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 8
Exact Mass 373.09437113 g/mol
Monoisotopic Mass 373.09437113 g/mol
Topological Polar Surface Area 196 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 636
Isotope Atom Count 0
Defined Atom Stereocenter Count 3
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Deacetylcephalosporin C is a 3-hydroxymethylcephalosporin having a (5-amino-5-carboxypentanoyl)amino group at the 7-position. It is a conjugate acid of a deacetylcephalosporin C(1-).