substances: 275985
This data as json
| inchi_id | inchi | inchikey |
|---|---|---|
| 275985 | InChI=1S/C12H16N2S.C6H8O7.H2O/c1-10-6-9-15-11(10)4-5-12-13-7-3-8-14(12)2;7-3(8)1-6(13,5(11)12)2-4(9)10;/h4-6,9H,3,7-8H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);1H2/b5-4+;; | QBAKSTZTPARVAI-SFKRKKMESA-N |