112516-03-7
Product Name:
Phenol, 4,4'-[(2R,3R,4S,5S)-tetrahydro-3,4-dimethyl-2,5-furandiyl]bis[2,6-dimethoxy-, rel-
Formula:
C22H28O7
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 404.5 g/mol |
|---|---|
| XLogP3 | 3.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 6 |
| Exact Mass | 404.18350323 g/mol |
| Monoisotopic Mass | 404.18350323 g/mol |
| Topological Polar Surface Area | 86.6 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 445 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 4 |
| 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
Fragransin B1 is a natural product found in Myristica fragrans with data available.