input word = C00022508

Metabolite InformationStructural formula
Name Methyl ent-16-acetoxy-6-oxo-7,13Z-labdadien-15-oate
Formula C23H34O5
Mw 390.2406242
CAS RN 88862-10-6
C_ID C00022508 ,
InChIKey PHJRUQKEJPSVIY-YFMQVNLJNA-N
InChICode InChI=1S/C23H34O5/c1-15-12-19(25)21-22(3,4)10-7-11-23(21,5)18(15)9-8-17(13-20(26)27-6)14-28-16(2)24/h12-13,18,21H,7-11,14H2,1-6H3/b17-13+/t18-,21-,23+/m1/s1
SMILES C1CC([C@@H]2[C@@](C1)([C@@H](C(=CC2=O)C)CC/C(=C\C(=O)OC)/COC(=O)C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAcritopappus confertus Ref.
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