input word = C00012337

Metabolite InformationStructural formula
Name [3R-(3R*,3aS*,4R*,5E,9E,11aS*)]-2,3,3a,4,7,8,11,11a-Octahydro-4-hydroxy-3,6-dimethyl-2-oxocyclodeca[b]furan-10-carboxaldehyde
6alpha-Hydroxy-14-oxo-1(10)E,4E,germacradien-12,8alpha-olide
Formula C15H20O4
Mw 264.13615913
CAS RN 127072-56-4
C_ID C00012337 ,
InChIKey LIJQWAJRNJAWDC-REGNXPGSNA-N
InChICode InChI=1S/C15H20O4/c1-9-4-3-5-11(8-16)7-13-14(12(17)6-9)10(2)15(18)19-13/h5-6,8,10,12-14,17H,3-4,7H2,1-2H3/b9-6+,11-5+/t10-,12-,13+,14+/m1/s1
SMILES [C@H]12[C@@H](OC(=O)[C@@H]1C)C/C(=C\CC/C(=C/[C@H]2O)/C)/C=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSchkuhria pinnata Ref.
zoom in