| Properties | Image | Occurences in reactions |
MNX_ID | MNXM41630 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C22H22O9 |
charge | 0 |
mass | 430.12638 |
reference | lipidmapsM:LMPK12110740 |
InChIKey | ZRNTZPKUNIPEAL-YHAWUTMOSA-N |
InChI | InChI=1S/C22H22O9/c1-9-21(27)14(26)8-17(30-9)19-13(25)7-18-20(22(19)28)12(24)6-15(31-18)10-3-4-11(23)16(5-10)29-2/h3-7,9,14,17,21,23,25-28H,8H2,1-2H3/t9-,14?,17+,21-/m1/s1 |
SMILES | COc1cc(-c2cc(=O)c3c(O)c([C@@H]4CC(O)[C@H](O)[C@@H](C)O4)c(O)cc3o2)ccc1O |
|