input word = C00041298

Metabolite InformationStructural formula
Name 9,12,13-Trihydroxyoctadeca-10(E)-dienoic acid
(-)-9,12,13-Trihydroxyoctadeca-10(E)-dienoic acid
Formula C18H34O5
Mw 330.2406242
CAS RN 912550-34-6
C_ID C00041298 ,
InChIKey MDIUMSLCYIJBQC-BUHFOSPRNA-N
InChICode InChI=1S/C18H34O5/c1-2-3-7-11-16(20)17(21)14-13-15(19)10-8-5-4-6-9-12-18(22)23/h13-17,19-21H,2-12H2,1H3,(H,22,23)/b14-13+/t15-,16+,17-/m0/s1
SMILES CCCCCC(O)C(O)/C=C/C(O)CCCCCCCC(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeChenopodiaceaeSalsola tetrandra Ref.
zoom in