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490-54-0

490-54-0 structural image
Product Name: MARITIMEIN
Formula: C21H20O11
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P271:Use only outdoors or in a well-ventilated area.

COMPUTED DESCRIPTORS

Molecular Weight 448.4 g/mol
XLogP3 0.4
Hydrogen Bond Donor Count 7
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 4
Exact Mass 448.10056145 g/mol
Monoisotopic Mass 448.10056145 g/mol
Topological Polar Surface Area 186 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 714
Isotope Atom Count 0
Defined Atom Stereocenter Count 5
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

Maritimein is a natural product found in Bidens bipinnata, Viguiera dentata, and other organisms with data available.