COMPUTED DESCRIPTORS
| Molecular Weight | 1364.4 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 11 |
| Hydrogen Bond Acceptor Count | 21 |
| Rotatable Bond Count | 26 |
| Exact Mass | 1363.577629 g/mol |
| Monoisotopic Mass | 1363.577629 g/mol |
| Topological Polar Surface Area | 454 Ų |
| Heavy Atom Count | 93 |
| Formal Charge | 0 |
| Complexity | 3140 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 14 |
| Defined Bond Stereocenter Count | 3 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 4 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Aquacobalamin is a metabolite found in or produced by Escherichia coli (strain K12, MG1655).