input word = C00021708

Metabolite InformationStructural formula
Name 4alpha,5alpha-Epoxy-10alpha,14H-inuviscolide
Formula C15H20O3
Mw 248.1412445
CAS RN 68776-54-5
C_ID C00021708 ,
InChIKey AIHKZOVNPAYCEL-QSXQSGGJNA-N
InChICode InChI=1S/C15H20O3/c1-8-6-12-10(9(2)13(16)17-12)7-15-11(8)4-5-14(15,3)18-15/h8,10-12H,2,4-7H2,1,3H3/t8-,10+,11-,12-,14+,15-/m0/s1
SMILES C=C1C(=O)O[C@H]2C[C@H](C)[C@@H]3CC[C@@]4(C)O[C@@]34C[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeInula helenium Ref.
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