input word = C00022449

Metabolite InformationStructural formula
Name ent-15-Hydroxy-7,13-labdadien-2-one
Formula C22H34O3
Mw 346.25079495
CAS RN 120838-40-6
C_ID C00022449 ,
InChIKey LABJRCCKHONGEZ-MYJUBCEFNA-N
InChICode InChI=1S/C22H34O3/c1-15(11-12-25-17(3)23)7-9-19-16(2)8-10-20-21(4,5)13-18(24)14-22(19,20)6/h8,11,19-20H,7,9-10,12-14H2,1-6H3/b15-11+/t19-,20-,22-/m1/s1
SMILES CC(=O)OC/C=C(C)CC[C@@H]1C(C)=CC[C@@H]2C(C)(C)CC(=O)C[C@@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBaccharis sternbergiana Ref.
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