| Properties | Image | Occurences in reactions |
MNX_ID | MNXM161098 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C17H9Na3O10S3 |
charge | 0 |
mass | 537.90509 |
reference | chebi:85381 |
InChIKey | GUGNSJAORJLKGP-UHFFFAOYSA-K |
InChI | InChI=1S/C17H12O10S3.3Na/c1-27-12-6-13(28(18,19)20)9-4-5-11-15(30(24,25)26)7-14(29(21,22)23)10-3-2-8(12)16(9)17(10)11;;;/h2-7H,1H3,(H,18,19,20)(H,21,22,23)(H,24,25,26);;;/q;3*+1/p-3 |
SMILES | COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43.[Na+].[Na+].[Na+] |
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