input word = C00021081

Metabolite InformationStructural formula
Name 4beta-Hydroxy-3-oxo-1alpha,10betaH-pseudoguaia-11(13)-en-12,8beta-olide
Formula C15H20O4
Mw 264.13615913
CAS RN 125289-79-4
C_ID C00021081 ,
InChIKey RSIRJQBBTRXQHY-RRLHLGKZNA-N
InChICode InChI=1S/C15H20O4/c1-7-4-12-9(8(2)14(18)19-12)6-15(3)10(7)5-11(16)13(15)17/h7,9-10,12-13,17H,2,4-6H2,1,3H3/t7-,9-,10?,12-,13+,15+/m1/s1
SMILES [C@@H]12[C@](C[C@H]3[C@@H](C[C@H]1C)OC(=O)C3=C)([C@H](C(=O)C2)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeGeigeria ornativa Ref.
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