input word = C00022428

Metabolite InformationStructural formula
Name 17-Oxo-13-labden-15,16-olide
Formula C20H28O3
Mw 316.20384476
CAS RN 97457-11-9
C_ID C00022428 ,
InChIKey FURMTLFRXKAGLX-KNQOLKPNNA-N
InChICode InChI=1S/C20H28O3/c1-19(2)9-4-10-20(3)16(15(12-21)6-8-17(19)20)7-5-14-11-18(22)23-13-14/h6,11-12,16-17H,4-5,7-10,13H2,1-3H3/t16-,17-,20-/m0/s1
SMILES C1CC([C@H]2[C@@](C1)([C@H](C(=CC2)C=O)CCC1=CC(=O)OC1)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBaccharis eggersii Ref.
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