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245550-65-6

245550-65-6 structural image
Product Name: Glucoberteroin potassium salt
Formula: C13H25KNO9S3*
Synonyms: 5-(Methylthio)pentylglucosinolate potassium salt
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H317:Sensitisation, Skin
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:IF ON SKIN: wash with plenty of soap and water.

COMPUTED DESCRIPTORS

Molecular Weight 473.6 g/mol
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 11
Exact Mass 473.02502635 g/mol
Monoisotopic Mass 473.02502635 g/mol
Topological Polar Surface Area 228 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 546
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 2
Compound Is Canonicalized Yes