input word = C00044564

Metabolite InformationStructural formula
Name Avrainvilleol
Formula C14H12Br2O4
Mw 401.91023467
CAS RN 87402-66-2
C_ID C00044564 ,
InChIKey JAJYCHVUMIGCEE-UHFFFAOYSA-N
InChICode InChI=1S/C14H12Br2O4/c15-10-4-7(1-2-12(10)18)3-9-8(6-17)5-11(16)14(20)13(9)19/h1-2,4-5,17-20H,3,6H2
SMILES c1(c(cc(c(c1O)Cc1cc(c(cc1)O)Br)CO)Br)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeUdoteaceaeAvrainvillia spp. Ref.
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OrganismAvrainvillia spp.
ReferenceTakamatsu,J.Nat.Prod.,66,(2003),605