- Monograph ID
- M9953
- Title
- Sinigrin
- UNII
- 50UM64RMBJ
- Molecular formula
- C10H16KNO9S2
- Molecular weight
- 397.45
- Percent composition
- C 30.22%, H 4.06%, K 9.84%, N 3.52%, O 36.23%, S 16.13%
- Standard InChI
- InChI=1S/C10H17NO9S2.K/c1-2-3-6(11-20-22(16,17)18)21-10-9(15)8(14)7(13)5(4-12)19-10;/h2,5,7-10,12-15H,1,3-4H2,(H,16,17,18);/q;+1/p-1/b11-6-;/t5-,7-,8+,9-,10+;/m1./s1
- Standard InChIKey
- QKFAFSGJTMHRRY-FVDOMRANSA-M
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