methysergide maleate salt methysergide maleate salt

structural formula

• numbering system
• physical property data
• toxicological data
• ecological data
• molecular structure data
• computing chemical data
• more
  • properties and stability
  • storage method
  • synthesis method
  • purpose

numbering system

cas number:129-49-7

mdl number:mfcd00083185

einecs number:204-950-9

rtecs number:ke5410000

brn number:none

pubchem number:24278129

physical property data

none yet

toxicological data

1, acute toxicity: rat oral ld5o: 200mg/kg

rat intravenous ld5o: 125mg/kg

mice orally ld5o: 581mg/kg

mouse intravenously ld5o: 185mg/kg

rabbit transvenous ld5o: 28mg/kg

2, reproductive toxicity: mice (female, before fertilization) abdominal cavity tdlo: 400ug/kg/1d

3 , mutagenicity: human lymphocyte genetic analysis and testing system: 100ug/kg/24h

mouse peritoneal cytogenetic analysis and testing system: 200mg/kg

mice intraperitoneal dominant lethality experiment: 100mg/kg

ecological data

none yet

molecular structure data

none yet

compute chemical data

1. reference value for hydrophobic parameter calculation (xlogp): none

2. number of hydrogen bond donors: 4

3. number of hydrogen bond acceptors: 7

4. number of rotatable chemical bonds: 6

5. number of tautomers: 2

6. topological molecule polar surface area 132

7. number of heavy atoms: 34

8. surface charge: 0

9. complexity: 697

10. number of isotope atoms: 0

11. determine the number of atomic stereocenters: 3

12. uncertain number of atomic stereocenters: 0

13. determine the number of chemical bond stereocenters: 1

14. number of uncertain chemical bond stereocenters: 0

15. number of covalent bond units: 2

properties and stability

none yet

storage method

none yet

synthesis method

none yet

purpose

none yet