| Properties | Image | Occurences in reactions |
MNX_ID | MNXM56555 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C16H12O12S2 |
charge | 0 |
mass | 459.97702 |
reference | lipidmapsM:LMPK12111173 |
InChIKey | KSFQKQXOBCTINQ-UHFFFAOYSA-N |
InChI | InChI=1S/C16H12O12S2/c1-25-16-13(28-30(22,23)24)7-12-14(15(16)18)10(17)6-11(26-12)8-2-4-9(5-3-8)27-29(19,20)21/h2-7,18H,1H3,(H,19,20,21)(H,22,23,24) |
SMILES | COc1c(OS(=O)(=O)O)cc2oc(-c3ccc(OS(=O)(=O)O)cc3)cc(=O)c2c1O |
|