input word = C00022658

Metabolite InformationStructural formula
Name 4alpha-Hydroperioxi-10alpha-hydroxy-8alpha-acetoxy-1alpha,5alpha,11betaH-guaia-2-en-12,6alpha-olide
Formula C17H24O7
Mw 340.15220312
CAS RN 112823-76-4
C_ID C00022658 ,
InChIKey PPRUPTSDFXQCQO-OCTSMAKDNA-N
InChICode InChI=1S/C17H24O7/c1-8-12-11(22-9(2)18)7-16(3,20)10-5-6-17(4,24-21)13(10)14(12)23-15(8)19/h5-6,8,10-14,20-21H,7H2,1-4H3/t8-,10+,11-,12+,13-,14-,16+,17+/m0/s1
SMILES [C@@H]12[C@@H]([C@@H]3[C@@H]([C@H](C[C@]1(O)C)OC(=O)C)[C@@H](C(=O)O3)C)[C@](C=C2)(C)OO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEriocephalus giessii Ref.
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