Chemical Properties of Solanidan-3-ol, (3«beta»,5«alpha»)- (CAS 474-08-8)

Solanidan-3-ol, (3«beta»,5«alpha»)-

InChI
InChI=1S/C27H45NO/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/h16-25,29H,5-15H2,1-4H3/t16?,17?,18?,19-,20?,21?,22?,23?,24?,25?,26?,27?/m1/s1
InChI Key
JALVTHFTYRPDMB-ICOJOGTOSA-N
Formula
C27H45NO
SMILES
CC1CCC2C(C)C3C(CC4C5CCC6CC(O)CCC6(C)C5CCC43C)N2C1
Molecular Weight1
399.65
CAS
474-08-8
Other Names
  • (22R,25S)-5«alpha»-Solanidan-3«beta»-ol
  • (22S,25S)-5-«alpha»-Solanidan-3-«beta»-ol
  • (22S,25S)-5-«alpha»-Solanidanine-3-«beta»-ol
  • 22R,25S-5«alpha»-Solanidanine-3«beta»-ol
  • 5«alpha»-Solanidan-3«beta»-ol
  • 5«alpha»-Solanidan-3«beta»-ol, (22R,25S)-
  • Demissidin
  • Demissidine
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Physical Properties

Property Value Unit Source
log10WS -5.83 Relay (1.0) Calculated Property
logPoct/wat 5.735 Crippen Calculated Property
McVol 341.980 ml/mol McGowan Calculated Property
Inp [3137.00; 3137.00]   Show Hide
Inp 3137.00 NIST
Inp 3137.00 NIST
Tfus 483.27 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Solanid-5-en-3-ol, (3«beta»)-. 14-.alpha.-Hydroxysparteine. Solanthrene. Dihydromultifiorine. Tetrahydrodeoxoargentamin. 4-Hydroxylupanine. 7,14-Methano-4H,6H-dipyrido[1,2-a:1',2'-e][1,5]diazocin-4-one, dodecahydro-2-hydroxy-, [2S-(2«alpha»,7«alpha»,7a«beta»,14«alpha»,14a«alpha»)]-. Chlorocarbene artifact of 7«alpha»-Hydroxy-1-methoxymethyl-8«alpha»-pyrrolizidine. Chlorocarbene aftifact of 7«beta»-Hydroxy-1-methylene-8«alpha»/«beta»-pyrrolizidine. Retamine. Hydroxylupanine. 13«beta»-hydroxylupanine. 13-Epihydroxyisolupanine. 14-epi-Hydroxysparteine. 4-Quinolinol,4-ethenyl-1-ethyldecahydro-2-methyl-(2«alpha»,4«beta»,4a«alpha»,8a«beta»).

Find more compounds similar to Solanidan-3-ol, (3«beta»,5«alpha»)-.

Sources

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