input word = C00007817

Metabolite InformationStructural formula
Name 2-Hydroxypropyl glucosinolate
Formula C10H19NO10S2
Mw 377.0450373
CAS RN
C_ID C00007817 ,
InChIKey GUFJTWBPQBCRFN-ZKJLKEJGNA-N
InChICode InChI=1S/C10H19NO10S2/c1-4(13)2-6(11-21-23(17,18)19)22-10-9(16)8(15)7(14)5(3-12)20-10/h4-5,7-10,12-16H,2-3H2,1H3,(H,17,18,19)/b11-6-/t4-,5+,7-,8-,9+,10+/m0/s1
SMILES O[C@@H]1[C@@H]([C@H]([C@H](O[C@@H]1CO)S/C(=N\OS(=O)(=O)O)/C[C@H](C)O)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Ala
Organism
Kingdom Family Species Reference
PlantaeCruciferaeArmoracia lapathifolia Ref.
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