input word = C00000182

Metabolite InformationStructural formula
Name 12S-HETE
12S-Hydroxyeicosatetraenoic acid
Formula C20H32O3
Mw 320.23514489
CAS RN
C_ID C00000182 ,
InChIKey ZNHVWPKMFKADKW-AAZMTKJTNA-N
InChICode InChI=1S/C20H32O3/c1-2-3-4-5-10-13-16-19(21)17-14-11-8-6-7-9-12-15-18-20(22)23/h7-11,13-14,17,19,21H,2-6,12,15-16,18H2,1H3,(H,22,23)/b9-7+,11-8+,13-10+,17-14+/t19-/m0/s1
SMILES CCCCC/C=C/C[C@@H](/C=C/C=C/C/C=C/CCCC(=O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--GracilariaceaeGracilaria lemaneiformis Ref.
PlantaeConstantineaConstantinea simplex Ref.
--Laurencia hybrida Ref.
--Laurencia spectabilis Ref.
--Murrayella periclados Ref.
--Platysiphonia miniata Ref.
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