| Properties | Image | Occurences in reactions |
MNX_ID | MNXM148976 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 1 |
in models (compartimentalized) |
0 |
|
formula | C21H32O4 |
charge | 0 |
mass | 348.23006 |
reference | metacycM:CPD-16830 |
InChIKey | JYZGDIADQSQUAG-POPLHLQASA-N |
InChI | InChI=1S/C21H32O4/c1-11(2)19-16-9-18(22)12(3)14-6-7-21(24,10-25-5)17(14)8-15(16)13(4)20(19)23/h8,11-15,18,22,24H,6-7,9-10H2,1-5H3/b17-8+/t12-,13+,14+,15+,18?,21?/m1/s1 |
SMILES | COCC1(O)CC[C@@H]2/C1=C\[C@@H]1C(=C(C(C)C)C(=O)[C@H]1C)CC(O)[C@@H]2C |
|