input word = C00022038

Metabolite InformationStructural formula
Name (E,E,E)-1,7-Dihydroxy-2,5,10,14-phytatetraen-13-one
Formula C20H32O3
Mw 320.23514489
CAS RN 79404-60-7
C_ID C00022038 ,
InChIKey DKSTUBPHCLFFAR-ROOLMNOENA-N
InChICode InChI=1S/C20H32O3/c1-16(2)14-19(22)15-18(4)9-7-12-20(5,23)11-6-8-17(3)10-13-21/h6,9-11,14,21,23H,7-8,12-13,15H2,1-5H3/b11-6+,17-10+,18-9+/t20-/m0/s1
SMILES C(=CC(=O)C/C(=C/CC[C@](/C=C/C/C(=C/CO)/C)(O)C)/C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AlgaeCystoseiraceaeCystoseira crinita Ref.
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OrganismCystoseira crinita
ReferenceAmico,Phytochem.,20,(1981),1085