| Properties | Image | Occurences in reactions |
MNX_ID | MNXM58944 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C22H22O8 |
charge | 0 |
mass | 414.13147 |
reference | lipidmapsM:LMPK12140412 |
InChIKey | NMDAXWXNNIQNFH-ISAWABDASA-N |
InChI | InChI=1S/C22H22O8/c1-11(10-29-12(2)23)3-5-14-16(25)8-18(27)21-19(28)9-20(30-22(14)21)13-4-6-15(24)17(26)7-13/h3-4,6-8,20,24-27H,5,9-10H2,1-2H3/b11-3+/t20-/m0/s1 |
SMILES | CC(=O)OC/C(C)=C/Cc1c(O)cc(O)c2c1O[C@H](c1ccc(O)c(O)c1)CC2=O |
|