isoalantolactone 470-17-7
InChIKey=CVUANYCQTOGILD-PQNSMMMDSA-N
InChI=1S/C15H20O2/c1-9-5-4-6-15(3)8-13-11(7-12(9)15)10(2)14(16)17-13/h11-13H,1-2,4-8H2,3H3/t11?,12-,13?,15+/m0/s1
C1(C(C2C[C@H]3(C(=C)CCC[C]3(CC2O1)C))=C)=O
C15H20O2 |
232.32 |
|
5.36 |
-4.7 |
1 |
4 |
2 |
0 |
0 |
4 |
2 |