126239-77-8
Product Name:
3-(4-Hydroxyphenyl)propenoic acid (2R)-1-(β-D-glucopyranosyloxy)-3-hydroxypropan-2-yl ester
Formula:
C18H24O10
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COMPUTED DESCRIPTORS
Molecular Weight | 400.4 g/mol |
---|---|
XLogP3 | -1.1 |
Hydrogen Bond Donor Count | 6 |
Hydrogen Bond Acceptor Count | 10 |
Rotatable Bond Count | 9 |
Exact Mass | 400.13694696 g/mol |
Monoisotopic Mass | 400.13694696 g/mol |
Topological Polar Surface Area | 166 Ų |
Heavy Atom Count | 28 |
Formal Charge | 0 |
Complexity | 505 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 6 |
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
Regaloside H is a natural product found in Lilium auratum, Lilium pensylvanicum, and Lilium mackliniae with data available.