495-85-2
Product Name:
METHYSTICIN
Formula:
C15H14O5
Synonyms:
(R)-6-[(E)-2-(1,3-Benzodioxol-5-yl)ethenyl]-5,6-dihydro-4-methoxy-2H-pyran-2-one;(6R)-6-[(1E)-2-(1,3-Benzodioxol-5-yl)ethenyl]-5,6- dihydro-4-methoxy-2H-pyran-2-one;d-Methysticin;Kavahin;Kavatin
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 274.27 g/mol |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 274.08412354 g/mol |
| Monoisotopic Mass | 274.08412354 g/mol |
| Topological Polar Surface Area | 54 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 428 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Methysticin is a member of 2-pyranones and an aromatic ether.