2D Structure | |
CID | 441524 |
IUPAC Name | [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 2-methyl-N-sulfooxypropanimidothioate |
InChI | InChI=1S/C10H19NO9S2/c1-4(2)9(11-20-22(16,17)18)21-10-8(15)7(14)6(13)5(3-12)19-10/h4-8,10,12-15H,3H2,1-2H3,(H,16,17,18)/t5-,6-,7+,8-,10+/m1/s1 |
InChI Key | WGIQZGDVCQDPTG-GBMPTNJUSA-N |
Canonical SMILES | None |
Isomeric SMILES | None |
Molecular Formula | C10H19NO9S2 |
Molecular Weight | 361.4 |
synonyms | ['Glucoputranjivin', '18432-16-1', '1-Methylethyl glucosinolate', 'DTXSID00331588', '[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 2-methyl-N-sulfooxypropanimidothioate', 'CHEBI:79331', '((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl) 2-methyl-N-sulfooxypropanimidothioate', 'DTXCID00282682', '((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl) (1Z)-2-methyl-N-sulfooxypropanimidothioate', 'SCHEMBL30484205', 'NS00094608', 'C08418', '[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] 2-methyl-N-sulfooxy-propanimidothioate', '2-methyl-N-sulfoxy-thiopropionimidic acid [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl] ester'] |
From Pubchem