input word = C00048303

Metabolite InformationStructural formula
Name 9-Hydroxy-(10E,12Z,15Z)-octadecatrienoic acid
Formula C18H30O3
Mw 294.21949482
CAS RN 89886-42-0
C_ID C00048303 ,
InChIKey RIGGEAZDTKMXSI-CVWPLEPBNA-N
InChICode InChI=1S/C18H30O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h3-4,6,8,11,14,17,19H,2,5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b4-3-,8-6-,14-11+/t17-/m1/s1
SMILES C(=O)(CCCCCCC[C@@H](/C=C/C=C\C/C=C\CC)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeIsatis tinctoria Ref.
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