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Homecas23109-05-9

23109-05-9

23109-05-9 structural image
Product Name: ALPHA-AMANITIN
Formula: C39H54N10O14S
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid; [Merck Index] Faintly beige powder; [MSDSonline]
Color/Form NEEDLES FROM METHANOL
Melting Point 254-255 °C
Optical Rotation SPECIFIC OPTICAL ROTATION: +191 DEG @ 20 °C/D; MAX ABSORPTION: 302 NM
Chemical Classes Biological Agents -> Mushroom Toxins

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06

Health Hazard
GHS08
GHS Hazard Statements H300:Acute toxicity,oral
H373:Specific target organ toxicity, repeated exposure
Precautionary Statement Codes P260:Do not breathe dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P270:Do not eat, drink or smoke when using this product.
P314:Get medical advice/attention if you feel unwell.
P301+P310:IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.
P405:Store locked up.

COMPUTED DESCRIPTORS

Molecular Weight 919.0 g/mol
XLogP3 -4.4
Hydrogen Bond Donor Count 13
Hydrogen Bond Acceptor Count 15
Rotatable Bond Count 7
Exact Mass 918.35416761 g/mol
Monoisotopic Mass 918.35416761 g/mol
Topological Polar Surface Area 400 Ų
Heavy Atom Count 64
Formal Charge 0
Complexity 1840
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 11
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

alpha-Amanitin or α-amanitin is a cyclic peptide of eight amino acids. It is possibly the most deadly of all the amatoxins, toxins found in several members of the Amanita genus of mushrooms, one being the Death cap (Amanita phalloides) as well as the Destroying angel, a complex of similar species, principally A. virosa and A. bisporigera. It is also found in the mushrooms Galerina marginata and Conocybe filaris. (L993)