input word = C00007859

Metabolite InformationStructural formula
Name 2-(alpha-L-Rhamnopyranosyloxy)benzyl glucosinolate
Formula C20H29NO14S2
Mw 571.1029461
CAS RN
C_ID C00007859 ,
InChIKey MNXOVJKRTWAMSF-XOYXICKONA-N
InChICode InChI=1S/C20H29NO14S2/c1-8-13(23)15(25)17(27)19(32-8)33-10-5-3-2-4-9(10)6-12(21-35-37(29,30)31)36-20-18(28)16(26)14(24)11(7-22)34-20/h2-5,8,11,13-20,22-28H,6-7H2,1H3,(H,29,30,31)/b21-12+/t8-,11+,13-,14-,15-,16-,17+,18+,19-,20+/m0/s1
SMILES O[C@@H]1[C@@H]([C@H]([C@H](O[C@@H]1CO)S/C(=N/OS(=O)(=O)O)/Cc1ccccc1O[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)C)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeResedaceaeReseda odorata Ref.
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