input word = C00048390

Metabolite InformationStructural formula
Name Fallaquinone
Formula C27H38O4
Mw 426.2770097
CAS RN 1131283-52-7
C_ID C00048390 ,
InChIKey BSOTZKGEWFTERO-PZZCTQNINA-N
InChICode InChI=1S/C27H38O4/c1-19(2)12-15-26(30)24(18-28)11-7-10-20(3)8-6-9-21(4)13-14-23-17-25(29)16-22(5)27(23)31/h8,11-13,16-17,26,28,30H,6-7,9-10,14-15,18H2,1-5H3/b20-8+,21-13+,24-11+/t26-/m1/s1
SMILES CC(C)=CCC(O)/C(=C/CC/C(C)=C/CC/C(C)=C/CC1=CC(=O)C=C(C)C1=O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
ChromalveolataSargassaceaeSargassum fallax Ref.
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