input word = C00022766

Metabolite InformationStructural formula
Name ent-7,13-Labdadien-15,16-olide
Formula C20H30O2
Mw 302.2245802
CAS RN 79383-87-2
C_ID C00022766 ,
InChIKey DVCPCCPPWBALGF-FIVHGIJGNA-N
InChICode InChI=1S/C20H30O2/c1-14-6-9-17-19(2,3)10-5-11-20(17,4)16(14)8-7-15-12-18(21)22-13-15/h6,12,16-17H,5,7-11,13H2,1-4H3/t16-,17+,20+/m1/s1
SMILES C1CC([C@H]2[C@@](C1)([C@@H](C(=CC2)C)CCC1=CC(=O)OC1)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAcritopappus longifolius Ref.
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OrganismAcritopappus longifolius
ReferenceBohlmann,Phytochem.,20,(1981),275