482-45-1
Product Name:
Isoimperatorin
Formula:
C16H14O4
Synonyms:
4-(3-Methylbut-2-enyloxy)furo[3,2-g]chromen-7-one;4-[(3-Methyl-2-buten-1-yl)oxy]-7H-furo[3,2-g][1]benzopyran-7-one
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Color/Form | Off-white, light brown solid |
|---|---|
| Melting Point | 98-100 °C |
| Stability/Shelf Life | Stable under recommended storage conditions. |
| Kovats Retention Index | 2394 |
COMPUTED DESCRIPTORS
| Molecular Weight | 270.28 g/mol |
|---|---|
| XLogP3 | 3.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 270.08920892 g/mol |
| Monoisotopic Mass | 270.08920892 g/mol |
| Topological Polar Surface Area | 48.7 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 436 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| 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
Isoimperatorin is a member of the class of psoralens that is psoralen substituted by a prenyloxy group at position 5. Isolated from Angelica dahurica and Angelica koreana, it acts as a acetylcholinesterase inhibitor. It has a role as a metabolite and an EC 3.1.1.7 (acetylcholinesterase) inhibitor.