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57749-43-6

57749-43-6 structural image
Product Name: EQUISETIN
Formula: C22H31NO4
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
Precautionary Statement Codes P260:Do not breathe dust/fume/gas/mist/vapours/spray.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P312:Call a POISON CENTER or doctor/physician if you feel unwell.

COMPUTED DESCRIPTORS

Molecular Weight 373.5 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 373.22530847 g/mol
Monoisotopic Mass 373.22530847 g/mol
Topological Polar Surface Area 77.8 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 722
Isotope Atom Count 0
Defined Atom Stereocenter Count 6
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 2
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Equisetin is a natural product found in Saccharopolyspora erythraea, Ferula equisetacea, and other organisms with data available.