Epibrassinolide

Chemical Information
24-epi-brassinolide is a brassinosteroid, a 3alpha-hydroxy steroid, a 2alpha-hydroxy steroid, a 22-hydroxy steroid and a 23-hydroxy steroid.
| CAS Number | 78821-43-9 |
| PubChem CID | 443055 |
| IUPAC Name | (1S,2R,4R,5S,7S,11S,12S,15R,16S)-15-[(2S,3R,4R,5R)-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-4,5-dihydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-8-one |
| Molecular Formula | C28H48O6 |
| Molecular Weight | 480.7 |
| XLogP | 4.8 |
| Topological Polar Surface Area | 107 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 5 |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 755 |
| Property | Value |
|---|---|
| Molecular Weight | 480.7 |
| XLogP3 | 4.8 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 5 |
| Exact Mass | 480.34508925 |
| Monoisotopic Mass | 480.34508925 |
| Topological Polar Surface Area | 107 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 755 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 13 |
| 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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