input word = C00000365

Metabolite InformationStructural formula
Name 12-oxo-PDA
12-Oxo-cis-10,15-phytodienoic acid
2-Cyclopentene-1-octanoic acid
Formula C18H28O3
Mw 292.20384476
CAS RN 85551-10-6
C_ID C00000365 ,
InChIKey PMTMAFAPLCGXGK-HQYJUFBQNA-N
InChICode InChI=1S/C18H28O3/c1-2-3-7-11-16-15(13-14-17(16)19)10-8-5-4-6-9-12-18(20)21/h3,7,13-16H,2,4-6,8-12H2,1H3,(H,20,21)/b7-3-/t15-,16-/m0/s1
SMILES C1=C[C@@H]([C@@H](C1=O)C/C=C\CC)CCCCCCCC(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeArabidopsis thaliana Ref.
PlantaePoaceaeZea mays Ref.
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