LUFFARIELLOLIDE
Bezeichnung:LUFFARIELLOLIDE
CAS-Nr111149-87-2
Englisch Name:LUFFARIELLOLIDE
CBNumberCB0200705
SummenformelC25H38O3
Molgewicht386.57
MOL-Datei111149-87-2.mol
LUFFARIELLOLIDE physikalisch-chemischer Eigenschaften
Siedepunkt | 541.7±50.0 °C(Predicted) |
Dichte | 1.006±0.06 g/cm3(Predicted) |
Löslichkeit | DMSO: soluble; Ethanol: soluble |
pka | 9.98±0.40(Predicted) |
Aggregatzustand | Pale yellow oil. |
InChI | InChI=1S/C25H38O3/c1-18(11-7-13-21-17-23(26)28-24(21)27)9-6-10-19(2)14-15-22-20(3)12-8-16-25(22,4)5/h10-11,17,24,27H,6-9,12-16H2,1-5H3/b18-11+,19-10+ |
InChIKey | JPWPYTMXSXYUPG-QZPYEDBESA-N |
SMILES | O1C(O)C(CC/C=C(\C)/CC/C=C(\C)/CCC2C(C)(C)CCCC=2C)=CC1=O |