| Properties | Image | Occurences in reactions |
MNX_ID | MNXM113634 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C20H28O9 |
charge | 0 |
mass | 412.17333 |
reference | chebi:66260 |
InChIKey | LQLCHKHILFZNKF-UHFFFAOYSA-N |
InChI | InChI=1S/C20H28O9/c1-2-3-4-5-6-7-8-9-13-12-28-20(16(13)23)10-14(17(24)25)19(29-20,18(26)27)11-15(21)22/h12,14H,2-11H2,1H3,(H,21,22)(H,24,25)(H,26,27) |
SMILES | CCCCCCCCCC1=COC2(CC(C(=O)O)C(CC(=O)O)(C(=O)O)O2)C1=O |
|