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METERGOLINE structure, CAS 17692-51-2

METERGOLINE

CAS Number17692-51-2

SynonymsMetergoline,[(8β)-1,6-Dimethylergolin-8-yl)methyl]carbamicacidphenylmethylester; EINECS 241-686-3; MFCD00153829

Molecular FormulaC25H29N3O2

Molecular Weight403.52

Purity98%

Density1.25g/cm3

Boiling Point612.5ºC at 760mmHg

Melting Point148-150 °C(lit.)

Flash Point

Appearance

EINECS

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Cat. No.: 2A-9060823 Purity: 98%
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Quality Control of [ 17692-51-2 ] Purity: 98% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number17692-51-2
Catalog No.2A-9060823
Chinese Name甲麦角林
SynonymsMetergoline,[(8β)-1,6-Dimethylergolin-8-yl)methyl]carbamicacidphenylmethylester; EINECS 241-686-3; MFCD00153829
Molecular FormulaC25H29N3O2
Molecular Weight403.52
Purity98
Density1.25g/cm3
Boiling Point612.5ºC at 760mmHg
Melting Point148-150 °C(lit.)
Water Solubility0.1 M HCl: 1.4 mg/mL
Storage Condition−20°C
ApplicationMetergoline is a psychoactive drug of the ergoline chemical family, commonly used as a ligand for various serotonin and dopamine receptors.
MDL NumberC25H29N3O2
SMILESCN1CC(CNC(=O)OCc2ccccc2)CC2c3cccc4c3c(cn4C)CC21
InChIInChI=1S/C25H29N3O2/c1-27-14-18(13-26-25(29)30-16-17-7-4-3-5-8-17)11-21-20-9-6-10-22-24(20)19(12-23(21)27)15-28(22)2/h3-10,15,18,21,23H,11-14,16H2,1-2H3,(H,26,29)/p+1/t18-,21+,23+/m0/s1
InChI KeyWZHJKEUHNJHDLS-QTGUNEKASA-N
MSDSmsds/60823_1_17692_51_2.pdf
BioactivityMetergoline is a psychoactive drug of the ergoline chemical class which acts as a ligand for various serotonin and dopamine receptors. Related Catalog Signaling Pathways >> GPCR/G Protein >> 5-HT Receptor Signaling Pathways >> Neuronal Signaling >> 5-HT Receptor Research Areas >> Neurological Disease Chemical & Physical Properties Density 1.25g/cm3 Boiling Point 612.5ºC at 760mmHg Melting Point 148-150 °C(lit.) Molecular Formula C25H29N3O2 Molecular Weight 403.51700 Flash Point 324.2ºC Exact Mass 403.22600 PSA 46.50000 LogP 4.39350 Vapour Pressure 0mmHg at 25°C InChIKey WZHJKEUHNJHDLS-QTGUNEKASA-N SMILES CN1CC(CNC(=O)OCc2ccccc2)CC2c3cccc4c3c(cn4C)CC21 Storage condition −20°C Water Solubility 0.1 M HCl: 1.4 mg/mL
Use ofMetergoline is a psychoactive drug of the ergoline chemical class which acts as a ligand for various serotonin and dopamine receptors. Properties Articles30 Name metergoline Synonym More Synonyms Metergoline Biological Activity Description Metergoline is a psychoactive drug of the ergoline chemical class which acts as a ligand for various serotonin and dopamine receptors. Related Catalog Signaling Pathways >> GPCR/G Protein >> 5-HT Receptor Signaling Pathways >> Neuronal Signaling >> 5-HT Receptor Research Areas >> Neurological Disease Chemical & Physical Properties Molecular Formula C25H29N3O2 Exact Mass 403.22600 PSA 46.50000 LogP 4.39350 InChIKey WZHJKEUHNJHDLS-QTGUNEKASA-N
Transport InfoProduct Name: Metaconine;Metaergoline
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