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CAS No 80-78-4 , Solanid-5-en-3-ol, (3b)-

  • Name: Solanid-5-en-3-ol, (3b)-
  • Synonyms: 22R,25S-Solanidine; Solatubine; Solanid-5-en-3-beta-ol;Solanid-5-en-3-ol, (3b)-; Solanid-5-en-3beta-ol;Solanidin; Solatubin; 22R,25S-Solanidanine;
  • CAS Registry Number:
  • Transport: 1544
  • Melting Point: 212-214°C
  • Flash Point: 223.5°C
  • Boiling Point: 503.1°C at 760 mmHg
  • Density: 1.1g/cm3
  • Refractive index: 1.576
  • Safety Statements: Hazard Codes T+Risk Statements 23/24/25Safety Statements 2-13-45-36/37/39-22RIDADR 1544RTECS WF0500000HazardClass 6.1(b)PackingGroup III
  • Hazard Symbols: T+: Very toxic;
  • Flash Point: 223.5°C
  • EINECS: 201-309-5
  • Molecular Weight: 397.63642
  • InchiKey: JVKYZPBMZPJNAJ-OQFNDJACSA-N
  • InChI: InChI=1S/C27H43NO/c1-16-5-8-23-17(2)25-24(28(23)15-16)14-22-20-7-6-18-
    13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16-17,19-25,29H,5,
    7-15H2,1-4H3/t16-,17+,19-,20+,21-,22-,23+,24-,25-,26-,27-/m0/s1
  • Risk Statements: 23/24/25
  • Molecular Formula: C27H43NO
  • Molecular Structure:CAS No:80-78-4 Solanid-5-en-3-ol, (3b)-

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References of Solanid-5-en-3-ol, (3b)-
Title: Solanidine
CAS Registry Number: 80-78-4
CAS Name: (3b)-Solanid-5-en-3-ol
Synonyms: solatubine
Molecular Formula: C27H43NO
Molecular Weight: 397.64
Percent Composition: C 81.55%, H 10.90%, N 3.52%, O 4.02%
Literature References: From Solanum spp., Solanaceae. Potato sprouts contain about 0.008%. Obtained by hydrolysis of solanine. Extraction procedure: Soltys, Wallenfels, Ber. 69, 811 (1936). Review on structure: Reichstein, Reich, Annu. Rev. Biochem. 15, 155 (1946). Stereochemistry: Rosen, Rosen, Chem. Ind. (London) 1954, 1581. Revised stereochemistry: H?hne et al., Tetrahedron 22, 673 (1966). Synthesis: Schreiber, Roensch, Ber. 97, 2362 (1964); Tetrahedron 21, 645 (1965); Kessar et al., ibid. 27, 2153 (1971).
Properties: Long needles from chloroform-methanol, mp 218-219°. Sublimes near mp with slight decompn. [a]D21 -29° (c = 0.5 in chloroform). Freely sol in benzene, chloroform; slightly in alcohol, methanol; almost insol in ether, water.
Melting point: mp 218-219°
Optical Rotation: [a]D21 -29° (c = 0.5 in chloroform)
 
Derivative Type: Hydrochloride
Molecular Formula: C27H43NO.HCl
Molecular Weight: 434.10
Percent Composition: C 74.70%, H 10.22%, N 3.23%, O 3.69%, Cl 8.17%
Properties: Prisms from 80% alcohol, dec 345°.
 
Derivative Type: Methyliodide
Molecular Formula: C27H43NO.CH3I
Molecular Weight: 539.58
Percent Composition: C 62.33%, H 8.59%, N 2.60%, O 2.97%, I 23.52%
Properties: Crystals from 50% alcohol, dec 286°.
 
Derivative Type: Acetylsolanidine
Molecular Formula: C29H45NO2
Molecular Weight: 439.67
Percent Composition: C 79.22%, H 10.32%, N 3.19%, O 7.28%
Properties: Crystals from alc, mp 208°.
Melting point: mp 208°