COMPUTED DESCRIPTORS
Molecular Weight | 254.13 g/mol |
---|---|
XLogP3 | -2.8 |
Hydrogen Bond Donor Count | 5 |
Hydrogen Bond Acceptor Count | 8 |
Rotatable Bond Count | 3 |
Exact Mass | 254.01915430 g/mol |
Monoisotopic Mass | 254.01915430 g/mol |
Topological Polar Surface Area | 145 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 357 |
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
3-phosphoshikimic acid is a phosphoshikimic acid. It has a role as an Escherichia coli metabolite. It is functionally related to a shikimic acid. It is a conjugate acid of a 3-phosphonatoshikimate(3-).