input word = C00022641

Metabolite InformationStructural formula
Name 7alpha-Hydroxy-8(17)-dehydrogrindelic acid
Formula C20H32O4
Mw 336.23005951
CAS RN 79491-93-3
C_ID C00022641 ,
InChIKey XOCFTIDAXQQSDD-LRYDYZEPNA-N
InChICode InChI=1S/C20H32O4/c1-13-14(21)11-15-17(2,3)7-6-8-19(15,5)20(13)10-9-18(4,24-20)12-16(22)23/h14-15,21H,1,6-12H2,2-5H3,(H,22,23)/t14-,15+,18-,19+,20-/m1/s1
SMILES C=C1[C@H](O)C[C@H]2C(C)(C)CCC[C@]2(C)[C@@]12CCC(C)(CC(=O)O)O2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeGrindelia camporum Ref.
PlantaeAsteraceaeGrindelia paludosa Ref.
PlantaeAsteraceaeGrindelia stricta Ref.
zoom in