COMPUTED DESCRIPTORS
| Molecular Weight | 887.6 g/mol |
|---|---|
| XLogP3 | -4.3 |
| Hydrogen Bond Donor Count | 10 |
| Hydrogen Bond Acceptor Count | 23 |
| Rotatable Bond Count | 21 |
| Exact Mass | 887.13633962 g/mol |
| Monoisotopic Mass | 887.13633962 g/mol |
| Topological Polar Surface Area | 409 Ų |
| Heavy Atom Count | 57 |
| Formal Charge | 0 |
| Complexity | 1540 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 5 |
| 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
4-hydroxybenzoyl-CoA is a hydroxybenzoyl-CoA that is the S-(4-hydroxybenzoyl) derivative of coenzyme A. It is functionally related to a benzoyl-CoA and a 4-hydroxybenzoic acid. It is a conjugate acid of a 4-hydroxybenzoyl-CoA(4-).