| Properties | Image | with InChI numbering | Occurences in reactions |
|---|
| MNX_ID | MNXM1380730 |
 |
 |
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 4 |
| in models (compartimentalized) |
0 |
|
| formula | C22H18O11 |
| charge | 0 |
| mass | 458.375 |
| reference | seedM:cpd09132 |
| InChIKey | XCIQCJDABRSRPD-DWSZVYAXSA-N |
| InChI | InChI=1S/C22H18O11/c1-7-13-8(5-10(23)14(7)20(29)33-3)4-9-15(16(13)25)19(28)21(30)12(24)6-11(32-2)18(27)22(21,31)17(9)26/h4-5,11,23,25,30-31H,6H2,1-3H3/t11?,21-,22-/m1/s1 |
| SMILES | [CH3:1][c:7]1[c:13]2[c:8]([cH:4][c:9]3[c:15]([c:16]2[OH:25])[C:19](=[O:28])[C@:21]2([OH:30])[C:12](=[O:24])[CH2:6][CH:11]([O:32][CH3:2])[C:18](=[O:27])[C@:22]2([OH:31])[C:17]3=[O:26])[cH:5][c:10]([OH:23])[c:14]1[C:20](=[O:29])[O:33][CH3:3] |
|
