input word = C00054226

Metabolite InformationStructural formula
Name 1,10:2,3-Diepoxy-4-hydroxy-11(13)-guaien-12,6-olide
Formula C15H18O5
Mw 278.11542369
CAS RN 113102-46-8
C_ID C00054226
InChIKey MLFUEPALQXNURC-KFSFOCSLSA-N
InChICode InChI=1S/C15H18O5/c1-6-7-4-5-13(2)15(20-13)9(8(7)18-12(6)16)14(3,17)10-11(15)19-10/h7-11,17H,1,4-5H2,2-3H3/t7-,8-,9-,10+,11-,13+,14-,15-/m0/s1
SMILES C=C1C(=O)O[C@H]2[C@H]1CC[C@@]1(C)O[C@@]13[C@H]1O[C@H]1[C@@](C)(O)[C@H]23
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTanacetum vulgare Ref.
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