Solanidine Solanidine

Structural formula

Business number	01RK
Molecular formula	C27H43NO
Molecular weight	397.64
label	Solanine; hydrolyzed solanine; solanine; Solatubine

• 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:80-78-4

MDL number:None

EINECS number:201-309-5

RTECS number:WF0500000

BRN number:None

PubChem ID:None

Physical property data

1. Characteristics: white long needle-shaped crystals.

2. Density (g/mL,25/4℃): Unsure

3. Relative vapor density (g/mL,AIR=1): Unsure

4. Melting point (ºC): 218 ～219℃, sublimates and slightly decomposes when close to the melting point

5. Boiling point (ºC,Normal pressure):345℃ (decomposition)

6. Boiling point (ºC,5.2kPa): Unsure

7. Refractive index: Uncertain

8. Flashpoint (ºC): Unsure

9. Specific optical rotation (º):-29 （c =0.5, chloroform).

10. Autoignition point or ignition temperature (ºC): Unsure

11. Vapor pressure (kPa,25ºC): Unsure2、 Teratogenicity

Mouse: 1800 mg/kg/3D (Continuous)

Ecological data

None yet

Molecular structure data

1. Molar refractive index: 119.72

2. Molar volume (m³/mol）：361.3

3. isotonic specific volume (90.2K):936.2

4. Surface Tension (dyne/cm):45.0

5. Polarizability（10^-24cm³):47.46

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): 6.1

2. Number of hydrogen bond donors: 1

3. Number of hydrogen bond acceptors: 2

4. Number of rotatable chemical bonds: 0

5. Number of tautomers: none

6. Topological molecule polar surface area 23.5

7. Number of heavy atoms: 29

8. Surface charge: 0

9. Complexity: 715

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 11

12. Uncertain number of atomic stereocenters: 0

13. Determine the number of chemical bond stereocenters: 0

14. Number of uncertain chemical bond stereocenters: 0

15. Number of covalent bond units: 1

Properties and stability

Double names are solanine and solanine. Needle-like crystals (chloroform–Methanol ), melting point218～ 219℃, sublimates and slightly decomposes when close to the melting point, derived from the Solanaceae plant potato (Solanum tuberosum L.) buds of peppers ( Capsicum frutescens L.) seeds, etc.

Storage method

This product should be sealed and stored in a cool place.

Synthesis method

It can be obtained by hydrolysis of solanine or artificially synthesized.

Purpose

For biochemical research.
Animal experiments have shown that it has a cardiotonic effect.

ascii-font-family: ‘Times New Roman’; mso-hansi-font-family: ‘Times New Roman’; mso-bidi-font-family: Arial”>（10^-24cm³）：47.46

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): 6.1

2. Number of hydrogen bond donors: 1

3. Number of hydrogen bond acceptors: 2

4. Number of rotatable chemical bonds: 0

5. Number of tautomers: none

6. Topological molecule polar surface area 23.5

7. Number of heavy atoms: 29

8. Surface charge: 0

9. Complexity: 715

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 11

12. Uncertain number of atomic stereocenters: 0

13. Determine the number of chemical bond stereocenters: 0

14. Number of uncertain chemical bond stereocenters: 0

15. Number of covalent bond units: 1

Properties and stability

Double names are solanine and solanine. Needle-like crystals (chloroform–Methanol ), melting point218～ 219℃, sublimates and slightly decomposes when close to the melting point, derived from the Solanaceae plant potato (Solanum tuberosum L.) buds of peppers ( Capsicum frutescens L.) seeds, etc.

Storage method

This product should be sealed and stored in a cool place.

Synthesis method

It can be obtained by hydrolysis of solanine or artificially synthesized.

Purpose

For biochemical research.
Animal experiments have shown that it has a cardiotonic effect.