| Properties | Image | Occurences in reactions |
MNX_ID | MNXM163421 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 4 |
in models (compartimentalized) |
4 |
|
formula | C20H27O3 |
charge | -1 |
mass | 315.19657 |
reference | biggM:CE7079 |
InChIKey | UPGVTUHMXWZYBQ-LVSGIGABSA-M |
InChI | InChI=1S/C20H28O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-19(23-18)16-14-17-20(21)22/h3-4,6-7,9-13,15,18-19H,2,5,8,14,16-17H2,1H3,(H,21,22)/p-1/b4-3-,7-6-,10-9-,12-11+,15-13+/t18-,19-/m0/s1 |
SMILES | CC/C=C\C/C=C\C/C=C\C=C\C=C\[C@@H]1O[C@H]1CCCC(=O)[O-] |
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