| Properties | Image | Occurences in reactions |
MNX_ID | MNXM166649 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 1 |
in models (compartimentalized) |
0 |
|
formula | C21H30O3 |
charge | 0 |
mass | 330.21949 |
reference | sabiorkM:26469 |
InChIKey | PWCLWZOSAFOXFL-ADDDSGAWSA-N |
InChI | InChI=1S/C21H30O3/c1-12(22)15-4-5-16-14-11-19(24)18-10-13(23)6-8-21(18,3)17(14)7-9-20(15,16)2/h10,14-17,19,24H,4-9,11H2,1-3H3/t14-,15+,16-,17-,19-,20+,21+/m0/s1 |
SMILES | CC(=O)[C@H]1CC[C@H]2[C@@H]3C[C@H](O)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |
|