Flavin adenine dinucleotide

Chemical Information
FAD is a flavin adenine dinucleotide in which the substituent at position 10 of the flavin nucleus is a 5'-adenosyldiphosphoribityl group. It has a role as a cofactor, a prosthetic group, a mouse metabolite, an Escherichia coli metabolite and a human metabolite. It is a vitamin B2 and a flavin adenine dinucleotide. It is a conjugate acid of a FAD(3-).
| CAS Number | 146-14-5 |
| PubChem CID | 643975 |
| IUPAC Name | [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4S)-5-(7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] hydrogen phosphate |
| Molecular Formula | C27H33N9O15P2 |
| Molecular Weight | 785.5 |
| XLogP | -5 |
| Topological Polar Surface Area | 356 |
| Hydrogen Bond Donor Count | 9 |
| Hydrogen Bond Acceptor Count | 20 |
| Rotatable Bond Count | 13 |
| Heavy Atom Count | 53 |
| Formal Charge | 0 |
| Complexity | 1560 |
| Property | Value |
|---|---|
| Molecular Weight | 785.5 |
| XLogP3 | -5 |
| Hydrogen Bond Donor Count | 9 |
| Hydrogen Bond Acceptor Count | 20 |
| Rotatable Bond Count | 13 |
| Exact Mass | 785.15713538 |
| Monoisotopic Mass | 785.15713538 |
| Topological Polar Surface Area | 356 Ų |
| Heavy Atom Count | 53 |
| Formal Charge | 0 |
| Complexity | 1560 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 7 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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