input word = C00020207

Metabolite InformationStructural formula
Name 12-Hydroxyalliacolide
Formula C15H22O5
Mw 282.14672381
CAS RN 79232-32-9
C_ID C00020207 ,
InChIKey DJTSUPJUCUNYFK-UHFFFAOYNA-N
InChICode InChI=1S/C15H22O5/c1-8-4-5-13(18)9(6-16)10(17)19-14(13)7-12(2,3)11-15(8,14)20-11/h8-9,11,16,18H,4-7H2,1-3H3/t8-,9+,11-,13+,14-,15-/m1/s1
SMILES [C@@]123[C@](CC[C@H]([C@]41[C@@H](C(C3)(C)C)O4)C)([C@H](C(=O)O2)CO)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiMarasmiaceaeMarasmius alliaceus Ref.
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OrganismMarasmius alliaceus
ReferenceFarrell,J. Chem. Soc. Perkin Trans. I,(1981),1790