521-48-2
Product Name:
ISOXANTHOHUMOL
Formula:
C21H22O5
Synonyms:
2,3-Dihydro-7-hydroxy-2-(4-hydroxyphenyl)-5-methoxy-8-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one;4,7-Dihydroxy-5-methoxy-8-prenylflavanone;Humulol;Isoxanthohumol;IXN
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COMPUTED DESCRIPTORS
| Molecular Weight | 354.4 g/mol |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 354.14672380 g/mol |
| Monoisotopic Mass | 354.14672380 g/mol |
| Topological Polar Surface Area | 76 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 519 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Isoxanthohumol is a member of flavanones.