input word = C00058197

Metabolite InformationStructural formula
Name 1-Thio-beta-D-glucopyranose 1-[N-(sulfooxy)benzenepentanimidate]
Formula C17H25NO9S2
Mw 451.09707287
CAS RN 76265-26-4
C_ID C00058197
InChIKey PJZFULXMEGMUDK-JMZFCNQTSA-N
InChICode InChI=1S/C17H25NO9S2/c19-10-12-14(20)15(21)16(22)17(26-12)28-13(18-27-29(23,24)25)9-5-4-8-11-6-2-1-3-7-11/h1-3,6-7,12,14-17,19-22H,4-5,8-10H2,(H,23,24,25)/b18-13-/t12-,14-,15+,16-,17+/m1/s1
SMILES O=S(=O)(O)O/N=C(/CCCCc1ccccc1)S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeArmoracia lapathifolia Ref.
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