input word = C00040285

Metabolite InformationStructural formula
Name Serrulatic acid
Formula C20H28O2
Mw 300.20893014
CAS RN 65122-62-5
C_ID C00040285 ,
InChIKey ODZQBEPDXUFJRX-JCJUTICPNA-N
InChICode InChI=1S/C20H28O2/c1-13(2)6-5-7-14(3)17-10-8-15(4)18-11-9-16(20(21)22)12-19(17)18/h6,9,11-12,14-15,17H,5,7-8,10H2,1-4H3,(H,21,22)/t14-,15+,17-/m0/s1
SMILES CC(C)=CCC[C@H](C)[C@@H]1CC[C@@H](C)c2ccc(C(=O)O)cc21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMyoporaceaeEremophila duttonii Ref.
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