36531-08-5
Product Name:
(6R,7S,8S)-5,6,7,8-Tetrahydro-8-(4-hydroxy-3-methoxyphenyl)-3-methoxy-6,7-dimethyl-2-naphthalenol
Formula:
C20H24O4
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 328.4 g/mol |
---|---|
XLogP3 | 4.5 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 3 |
Exact Mass | 328.16745924 g/mol |
Monoisotopic Mass | 328.16745924 g/mol |
Topological Polar Surface Area | 58.9 Ų |
Heavy Atom Count | 24 |
Formal Charge | 0 |
Complexity | 414 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 3 |
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
(+)-guaiacin is a lignan. It has a role as a metabolite.