input word = C00020847

Metabolite InformationStructural formula
Name 8alpha-Acetoxy-3alpha,4alpha,10beta-trihydroxy-1-guaien-12,6alpha-olide
Formula C17H24O7
Mw 340.15220312
CAS RN 119403-32-6
C_ID C00020847 ,
InChIKey KGGKPXJSOGJLKI-HGXZFAGONA-N
InChICode InChI=1S/C17H24O7/c1-7-12-10(23-8(2)18)6-16(3,21)9-5-11(19)17(4,22)13(9)14(12)24-15(7)20/h5,7,10-14,19,21-22H,6H2,1-4H3/t7-,10-,11+,12+,13-,14-,16-,17+/m0/s1
SMILES C12=C[C@H]([C@]([C@@H]1[C@@H]1[C@@H]([C@H](C[C@@]2(O)C)OC(=O)C)[C@@H](C(=O)O1)C)(O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArtemisia arborescens Ref.
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OrganismArtemisia arborescens
ReferenceGrandolini,Phytochem.,27,(1988),3670