| Properties | Image | Occurences in reactions |
MNX_ID | MNXM168664 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 1 |
in models (compartimentalized) |
0 |
|
formula | C20H22O9 |
charge | 0 |
mass | 406.12638 |
reference | sabiorkM:24748 |
InChIKey | XRHIELLXTVJOKM-NZYUWASCSA-N |
InChI | InChI=1S/C20H22O9/c1-9(10-3-4-12-8-13(27-2)6-5-11(12)7-10)19(26)29-20-16(23)14(21)15(22)17(28-20)18(24)25/h3-9,14-17,20-23H,1-2H3,(H,24,25)/t9-,14+,15+,16-,17+,20+/m0/s1 |
SMILES | COc1ccc2cc([C@H](C)C(=O)O[C@H]3O[C@@H](C(=O)O)[C@H](O)[C@@H](O)[C@@H]3O)ccc2c1 |
|