87688-13-9
Product Name:
7-[[(5,6-Epoxy-3,4,5,6,7,8-hexahydro-2,5-dimethylnaphthalen)-1-yl]methoxy]-6,8-dimethoxy-2H-1-benzopyran-2-one
Formula:
C26H34O6
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 442.5 g/mol |
|---|---|
| XLogP3 | 5.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 11 |
| Exact Mass | 442.23553880 g/mol |
| Monoisotopic Mass | 442.23553880 g/mol |
| Topological Polar Surface Area | 66.5 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 737 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
2H-1-Benzopyran-2-one, 7-((9-(3,3-dimethyloxiranyl)-3,7-dimethyl-2,6-nonadienyl)oxy)-6,8-dimethoxy-, (E,E)-(-)- is a natural product found in Achillea ochroleuca with data available.