input word = C00035037

Metabolite InformationStructural formula
Name 9S,12S,13S-Trihydroxy-10E-octadecenoic acid
Formula C18H34O5
Mw 330.2406242
CAS RN 232949-82-5
C_ID C00035037 ,
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 OC(=O)CCCCCCC[C@@H](/C=C/[C@@H]([C@@H](CCCCC)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeConnaraceaeRourea minor Ref.
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