Description
Eichlerialactone isolated from the herbs of Aglaia erythrosperma.
Synonyms
20-Hydroxy-4,8,14-trimethyl-4-methylene-18-nor-3,4-seco-5β-cholane-3,24-dioic acid γ-lactone
IUPAC Name
3-[(3S,3aR,5aR,6S,7S,9aR,9bR)-6,9a,9b-trimethyl-3-[(2S)-2-methyl-5-oxooxolan-2-yl]-7-prop-1-en-2-yl-1,2,3,3a,4,5,5a,7,8,9-decahydrocyclopenta[a]naphthalen-6-yl]propanoic acid
Molecular Formula
C27H42O4
Canonical SMILES
CC(=C)C1CCC2(C(C1(C)CCC(=O)O)CCC3C2(CCC3C4(CCC(=O)O4)C)C)C
InChI
InChI=1S/C27H42O4/c1-17(2)18-9-15-26(5)21(24(18,3)13-11-22(28)29)8-7-19-20(10-14-25(19,26)4)27(6)16-12-23(30)31-27/h18-21H,1,7-16H2,2-6H3,(H,28,29)/t18-,19+,20-,21+,24-,25+,26+,27-/m0/s1
InChIKey
LEKUPXHLKIIVCR-FAKJQIDCSA-N
Boiling Point
557.0±50.0 °C(Predicted)
Density
1.068±0.06 g/cm3(Predicted)