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Glyphosate isopropylammonium

CAT: 0931-T210019-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T210019-01Size:10 mg
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CAS Number
38641-94-0
Target
Apoptosis, Necroptosis, Autophagy
Related Pathways
Apoptosis, Autophagy
Bioactivity
Glyphosate isopropylammonium is a broad-spectrum, non-selective systemic biocide derived from the amino acid glycine. It inhibits the enzyme activity of 5-enolpyruvylshikimate-3-phosphate synthase (EPSPS) in the shikimate pathway, blocking the synthesis of aromatic amino acids tyrosine, phenylalanine, and tryptophan. Additionally, Glyphosate isopropylammonium induces oxidative stress, neuroinflammation, and mitochondrial dysfunction, leading to neuronal death through autophagy, necrosis, or apoptosis, resulting in behavioral and motor disturbances.
Smiles
O=C(O)CNCP(=O)(O)O.NC(C)C
Molecular Formula
C6H17N2O5P
Molecular Weight
228.18
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Roundup

Glyphosate-isopropylammonium is an organic molecular entity.

CAS Number38641-94-0
PubChem CID38078
IUPAC Name2-(phosphonomethylamino)acetic acid;propan-2-amine
Molecular FormulaC6H17N2O5P
Molecular Weight228.18
Topological Polar Surface Area133
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count14
Formal Charge0
Complexity173
SMILES
CC(C)N.C(C(=O)O)NCP(=O)(O)O
InChI
InChI=1S/C3H8NO5P.C3H9N/c5-3(6)1-4-2-10(7,8)9;1-3(2)4/h4H,1-2H2,(H,5,6)(H2,7,8,9);3H,4H2,1-2H3
InChIKey
ZEKANFGSDXODPD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Roundup
CAS: 38641-94-0
CID: 38078
Formula: C6H17N2O5P
MW: 228.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight228.18
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass228.08750864
Monoisotopic Mass228.08750864
Topological Polar Surface Area133 Ų
Heavy Atom Count14
Formal Charge0
Complexity173
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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HY-B0863BGlyphosate (isopropylammonium)
GTR19262556-01Glyphosate isopropylammonium
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