input word = C00056288

Metabolite InformationStructural formula
Name delta8-Isopimaric acid
Formula C20H30O2
Mw 302.2245802
CAS RN 3625-01-2
C_ID C00056288
InChIKey BFPAVSSBPLQXJZ-GSEOLPGOSA-N
InChICode InChI=1S/C20H30O2/c1-5-18(2)12-9-15-14(13-18)7-8-16-19(15,3)10-6-11-20(16,4)17(21)22/h5,16H,1,6-13H2,2-4H3,(H,21,22)/t16-,18+,19-,20-/m1/s1
SMILES [H][C@@]1(CCC2=C3CC[C@@](C)(C2)C=C)[C@@]3(CCC[C@]1(C(O)=O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaePinus edulis Ref.
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