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Ro 3-0412

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Ro 3-0412
Names

Preferred IUPAC name 3--N,N,N-trimethylanilinium methyl sulfate
Other names Dimethylphosphostigmine
Identifiers
CAS Number	77967-17-0
3D model (JSmol)	Interactive image
ChemSpider	48765
PubChem CID	53991
CompTox Dashboard (EPA)	DTXSID50228631
InChI InChI=1S/C11H19NO4P.CH4O4S/c1-12(2,3)10-7-6-8-11(9-10)16-17(13,14-4)15-5;1-5-6(2,3)4/h6-9H,1-5H3;1H3,(H,2,3,4)/q+1;/p-1Key: SEPBMCLYOUSLFT-UHFFFAOYSA-M
SMILES C(C)(C)c1cccc(c1)OP(=O)(OC)OC.COS(=O)(=O)
Properties
Chemical formula	C₁₂H₂₂NO₈PS
Molar mass	371.34 g·mol
Hazards
Lethal dose or concentration (LD, LC):
LD₅₀ (median dose)	0.57 mg/kg (mice, intravenous)
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). Infobox references

Chemical compound

Ro 3-0412 is an acetylcholinesterase inhibitor. It is the organophosphate analog of neostigmine.

See also

References

BURGEN, AS; HOBBIGER, F (December 1951). "The inhibition of cholinesterases by alkyl-phosphates and alkylphenolphosphates". British Journal of Pharmacology and Chemotherapy. 6 (4): 593–605. doi:10.1111/j.1476-5381.1951.tb00670.x. PMC 1509150. PMID 14904884.

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Acetylcholine metabolism and transport modulators

Enzyme
(modulators)

ChATTooltip Choline acetyltransferase

AChETooltip Acetylcholinesterase

BChETooltip Butyrylcholinesterase

Inhibitors: Affinine
Affinisine
Conodurine
Cymserine
Ladostigil
Profenamine (ethopropazine)
Rivastigmine
Tacrine
ZINC-12613047
Many of the other AChE inhibitors listed above

Transporter
(modulators)

CHTTooltip Choline transporter

Inhibitors: Hemicholinium-3 (hemicholine)
Triethylcholine

Enhancers: Coluracetam

VAChTTooltip Vesicular acetylcholine transporter

Inhibitors: Vesamicol

Release
(modulators)

SNAP-25Tooltip Synaptosomal-associated protein 25 inactivators: Botulinum toxin (A, C, E)

VAMPTooltip Vesicle-associated membrane protein inactivators: Botulinum toxin (B, D, F, G)

Others: Bungarotoxins (β-bungarotoxin, γ-bungarotoxin)

LPHNTooltip Latrophilin agonists: α-Latrotoxin

Others: Atracotoxins (e.g., robustoxin, versutoxin)
Crotoxin

See also: Receptor/signaling modulators; Muscarinic acetylcholine receptor modulators; Nicotinic acetylcholine receptor modulators

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