input word = C00020204

Metabolite InformationStructural formula
Name Alliacolide
Formula C15H22O4
Mw 266.15180919
CAS RN 66389-08-0
C_ID C00020204 ,
InChIKey LLRILYDNXOIONB-UHFFFAOYNA-N
InChICode InChI=1S/C15H22O4/c1-8-5-6-13(17)9(2)10(16)18-14(13)7-12(3,4)11-15(8,14)19-11/h8-9,11,17H,5-7H2,1-4H3/t8-,9+,11+,13-,14+,15+/m0/s1
SMILES [C@@]123[C@](CC[C@@H]([C@]41[C@@H](C(C3)(C)C)O4)C)([C@@H](C(=O)O2)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiMarasmiaceaeMarasmius alliaceus Ref.
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