COMPUTED DESCRIPTORS
Molecular Weight | 374.6 g/mol |
---|---|
XLogP3 | 8.2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 16 |
Exact Mass | 374.28209507 g/mol |
Monoisotopic Mass | 374.28209507 g/mol |
Topological Polar Surface Area | 43.4 Ų |
Heavy Atom Count | 27 |
Formal Charge | 0 |
Complexity | 526 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
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
Irisquinone is a natural product found in Iris pallasii, Iris sibirica, and other organisms with data available.