97169-13-6
Product Name:
β,β-Caroten-4-one, 3,3',4'-trihydroxy-, (3S,3'S,4'R)- (9CI)
Formula:
C40H54O4
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 598.9 g/mol |
|---|---|
| XLogP3 | 9.5 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 10 |
| Exact Mass | 598.40221020 g/mol |
| Monoisotopic Mass | 598.40221020 g/mol |
| Topological Polar Surface Area | 77.8 Ų |
| Heavy Atom Count | 44 |
| Formal Charge | 0 |
| Complexity | 1410 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 3 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 9 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
beta,beta-Caroten-4-one, 3,3',4'-trihydroxy-, (3S,3'S,4'R)- is a natural product found in Salmo salar with data available.